Anti-infectives are drugs that can either kill an infectious agent or inhibit it from spreading. Anti-infectives include antibiotics and antibacterials, antifungals, antivirals and antiprotozoals.

Antibiotics specifically treat infections caused by bacteria, most commonly used types of antibiotics are: Aminoglycosides, Penicillins, Fluoroquinolones, Cephalosporins, Macrolides, and Tetracyclines. New other approaches such as photodynamic therapy (PDT) and antibacterial peptides have been considered as alternatives to kill bacteria.

The high rates of morbidity and mortality caused by fungal infections are associated with the current limited antifungal arsenal and the high toxicity of the compounds. The most common antifungal targets include fungal RNA synthesis and cell wall and membrane components, though new antifungal targets are being investigated.

Viral infections occur when viruses enter cells in the body and begin reproducing, often causing illness. Viruses are classified as DNA viruses or RNA viruses, RNA viruses include retroviruses, such as HIV, are prone to mutate. The currently available antiviral drugs target 4 main groups of viruses: herpes, hepatitis, HIV and influenza viruses. Drug resistance in the clinical utility of antiviral drugs has raised an urgent need for developing new antiviral drugs.

Antiprotozoal drugs are medicines that treat infections caused by protozoa. Of which, malaria remains a major world health problem following the emergence and spread of Plasmodium falciparum that is resistant to the majority of antimalarial drugs. At present, antimalarial discovery approaches have been studied, such as the discovery of antimalarials from natural sources, chemical modifications of existing antimalarials, the development of hybrid compounds, testing of commercially available drugs that have been approved for human use for other diseases and molecular modelling using virtual screening technology and docking.

References:
[1] Scorzoni L, et al. Front Microbiol. 2017 Jan 23;8:36.
[2] Dehghan Esmatabadi MJ, et al. Cell Mol Biol (Noisy-le-grand). 2017 Feb 28;63(2):40-48.
[3] Raymund R, et al. Mayo Clin Proc. 2011 Oct; 86(10):1009-1026.
[4] Aguiar AC, et al. Mem Inst Oswaldo Cruz. 2012 Nov;107(7):831-45.


Anti-infection >
Arenavirus Bacterial CMV Enterovirus Filovirus Fungal HBV HCV HIV HSV Influenza Virus Parasite Reverse Transcriptase RSV SARS-CoV
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Kadsulignan N

Kadsulignan N, a natural product has anti-HIV activity (EC50: 43.56 μM). Kadsulignan N is also a COX-2 ligand (Ki: 72.24 nM)[1][2].

  • CAS Number: 163564-58-7
  • MF: C24H30O7
  • MW: 430.491
  • Catalog: HIV
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 545.1±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 217.0±30.0 °C

Valacyclovir

Valacyclovir is an antiviral drug used in the management of herpes simplex, herpes zoster, and herpes B. IC50 Value: 2.9 microg/ml (for HSV-1 W)[4]. Target: HSV infectionin vitro: VACV uptake was concentration dependent and saturable with a Michaelis-Menten constant and maximum velocity of 1.64 +/- 0.06 mM and 23.34 +/- 0.36 nmol/mg protein/5 min, respectively. A very similar Km value was obtained in hPEPT1/CHO cells and in rat and rabbit tissues and Caco-2 cells, suggesting that hPEPT1 dominates the intestinal transport properties of VACV in vitro [5]. in vivo: For treatment of a first episode of genital herpes, a large comparative trial has shown that valacyclovir (1 g twice a day) is as effective as acyclovir (200 mg five times a day) when given for 10 days. For treating recurrences, two trials show that valacyclovir is as effective as acyclovir (200 mg five times a day) with a treatment period of 5 days. A daily dose of 1 g of valacyclovir is as effective as 2 g daily. Valacyclovir can be administered once a day[1]. The concentrations of acyclovir in serum and CSF were measured at steady state after 6 days of oral treatment with 1,000 mg of valacyclovir three times a day [2]. EC50 values of PE and AC in 3T3 cells were 0.02 and 0.01 ug/ml, while values in BHK cells were 0.2 and 0.03 ug/ml. Treatment of infected immunosuppressed mice and FA and VA (b.i.d., 5.5 days) reduced the proportion with erythema from 100% to 24% and 38%, and eliminated ear paralysis, ear lesions (vesicles, etc) and death. Virus was absent from ear and brainstem by day 6, but reappeared after discontinuation in mice treated with VA [3].Clinical trial: Evaluation of Valaciclovir in Patients with Chickenpox. Phage3

  • CAS Number: 124832-26-4
  • MF: C13H20N6O4
  • MW: 324.336
  • Catalog: HSV
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: 309.7ºC

Pinocembrin chalcone

Pinocembrin chalcone (2',4',6'-Trihydroxychalcone) is an antibacterial compound from Helichrysum Trilineatum. Pinocembrin chalcone can prevent gastric ulcers in rats[1].

  • CAS Number: 4197-97-1
  • MF: C15H12O4
  • MW: 256.25300
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 189.9℃
  • Flash Point: N/A

Vilobelimab

Vilobelimab (CaCP-29, IFX-1) is a monoclonal anti-C5a antibody to the allergen C5a, a pro-inflammatory complement division product that plays a central role in mediating organ dysfunction. Vilobelimab acts as a C5a inhibitor, inhibiting neutrophil activation, chemotaxis, and reducing inflammatory signalling, and may be used in studies related to sepsis, COVID-19, etc[1].

  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Antibacterial agent 158

Antibacterial agent 158 (compound 6c), a Micrococcin analogue, and is effective against impetigo and C. difficile infection (CDI)[1].

  • CAS Number: 2804045-21-2
  • MF: C54H61N15O8S6
  • MW: 1240.55
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

β-Lactamase-IN-5

β-Lactamase-IN-5 is a β-lactamase inhibitor extracted from patent WO2013149121A1, compound 720. β-Lactamase-IN-5 can be used for the research of bacterial infections[1].

  • CAS Number: 1463521-39-2
  • MF: C11H17N5O6S
  • MW: 347.35
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Influenza A virus-IN-6

Influenza A virus-IN-6 (compound 16j) is a potent and selective influenza A virus inhibitor with an IC50 of 3.88 µM and CC50 of 36.64 µM. Influenza A virus-IN-6 shows anti-IAV activity with low cytotoxicity[1].

  • CAS Number: 2464415-31-2
  • MF: C25H23N5O
  • MW: 409.48
  • Catalog: Influenza Virus
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Influenza virus-IN-7

Influenza virus-IN-7 (Example 16) is an orally active cap-dependent endonuclease inhibitor that can be used for the research of influenza viral infectious diseases[1].

  • CAS Number: 2703046-92-6
  • MF: C29H26F2N4O7S
  • MW: 612.60
  • Catalog: Influenza Virus
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Coniferyl alcohol

(E)-Coniferyl alcohol is the isomer of Coniferyl alcohol. Coniferyl alcohol is an intermediate in biosynthesis of eugenol and of stilbenoids and coumarin. Coniferyl alcohol specifically inhibits fungal growth[1][2].

  • CAS Number: 32811-40-8
  • MF: C10H12O3
  • MW: 180.20000
  • Catalog: Fungal
  • Density: 1.1272g/ml
  • Boiling Point: N/A
  • Melting Point: 75-76℃
  • Flash Point: N/A

Methyl 5-hydroxynaphtho[1,2-b]furan-4-carboxylate

Furomollugin is a natural product with antioxidant and antibacterial activities, can be isolated from Rubia cordifolia. Furomollugin lacks potent anti-tyrosinase activity, but also exhibits significant anticancer property[1].

  • CAS Number: 61658-41-1
  • MF: C14H10O4
  • MW: 242.227
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 391.6±22.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 190.6±22.3 °C

2-Phenylethanol-d5

2-Phenylethanol-d5 is the deuterium labeled 2-Phenylethanol[1]. 2-Phenylethanol (Phenethyl alcohol), extracted from rose, carnation, hyacinth, Aleppo pine, orange blossom and other organisms, is a colourless liquid. It has a pleasant floral odor and also an autoantibiotic produced by the fungus Candida albicans[2]. It is used as an additive in cigarettes and also used as a preservative in soaps due to its stability in basic conditions.

  • CAS Number: 35845-63-7
  • MF: C8H5D5O
  • MW: 127.19500
  • Catalog: Bacterial
  • Density: 1.062 g/cm3
  • Boiling Point: 218.199ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 98.432ºC

Phenylethyl isothiocyanate

2-Phenylethyl isothiocyanate is a potent antifungal agent. 2-Phenylethyl isothiocyanate significantly inhibited spore germination and mycelial growth of Alternaria alternata, with a MIC (minimum inhibitory concentration) of 1.22 mM. The antifungal effect of 2-Phenylethyl isothiocyanate against Alternaria alternata might be via reduction in toxin content and breakdown of cell membrane integrity[1][2].

  • CAS Number: 2257-09-2
  • MF: C9H9NS
  • MW: 163.23900
  • Catalog: Fungal
  • Density: 1.094 g/mL at 25 °C(lit.)
  • Boiling Point: 75 °C0.25 mm Hg
  • Melting Point: N/A
  • Flash Point: >230 °F

1-(2,6-DIHYDROXY-4-METHOXYPHENYL)ETHANONE

2,6-Dihydroxy-4-methoxyacetophenone is a phytoalexin, that can be isolated from the root tissue of Sanguisorba minor. 2,6-Dihydroxy-4-methoxyacetophenone exhibits antifungal activity. 2,6-Dihydroxy-4-methoxyacetophenone is a strong germination inhibitor on B. cinerea[1].

  • CAS Number: 7507-89-3
  • MF: C9H10O4
  • MW: 182.17300
  • Catalog: Fungal
  • Density: 1.284 g/cm3
  • Boiling Point: 356.7ºC at 760 mmHg
  • Melting Point: 144ºC
  • Flash Point: 146.3ºC

Squalamine

Squalamine(MSI-1256) is an aminosterol compound with potent broad spectrum antiviral activity.IC50 value: Target: in vitro: squalamine can strongly displace membrane-bound cationic proteins such as Rac1, a ρ-GTPase recruited to the inner leaflet of the eukaryotic cytoplasmic membrane for the actin remodeling necessary for endocytosis. At concentrations between 20 and 60 μg/mL, squalamine has been shown to inhibit a broad array of growth factor-induced, actin-dependent responses in endothelial cells, including cell migration, cell division, and vascular tube formation in a 3D matrix [1]. Squalamine effectively inhibited HBV replication in human primary hepatocytes when added either during the initial exposure of virus to the cells or at 24 h after infection. A similar study was performed to evaluate the effect of squalamine on the replication of HDV. Squalamine was introduced at 20 μg/mL during HDV exposure, and the effects were measured at day 7 when total RNA was extracted and assayed for HDV RNA sequences [1]. in vivo: one time daily treatment with squalamine (15 or 30 mg/kg per d s.c.) was started beginning on day 1 or 2 after viral administration and continuing until day 8 or 9, respectively. Survival was monitored, and animals that remained alive by day 21 were considered cured [1].

  • CAS Number: 148717-90-2
  • MF: C34H65N3O5S
  • MW: 627.96200
  • Catalog: Bacterial
  • Density: 1.13g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

AmphotericinB

Amphotericin B methyl ester is the methyl ester derivative of the polyene antibiotic Amphotericin B (A634250). Amphotericin B methyl ester is the cholesterol-binding compound possesses significant antifungal activity. Amphotericin B methyl ester disrupts HIV-1 particle production and potently inhibits HIV-1 replication[1][2].

  • CAS Number: 36148-89-7
  • MF: C48H75NO17
  • MW: 938.106
  • Catalog: Fungal
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 1102.6±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 620.6±34.3 °C

BEPRIDIL HYDROCHLORIDE MONOHYDRATE

Bepridil ((±)-Bepridil) is a calcium channel blocking agent used as antiarrhythmic agent. Bepridil inhibits both calcium and sodium currents, has research potential in certain ischemia-induced ventricular arrhythmias. Bepridil also has strong inhibition of SARS-CoV-2 from entry and replication inside Vero E6 and A549 cells[1][2].

  • CAS Number: 64706-54-3
  • MF: C24H34N2O
  • MW: 366.54000
  • Catalog: SARS-CoV
  • Density: 1.054 g/cm3
  • Boiling Point: 492.3ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 133.2ºC

Thalifoline

Thalifoline is an alkaloid isolated from the New Caledonian plant Cryptocarya longifolia[1] and displays antifungal activity[2].

  • CAS Number: 21796-15-6
  • MF: C11H13NO3
  • MW: 207.22600
  • Catalog: Fungal
  • Density: 1.246g/cm3
  • Boiling Point: 432.1ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 215.1ºC

SDZ 224-015

SDZ 224-015 is an orally active inhibitor of the interleukin-1 beta (IL-1β) converting enzyme and caspase-1. SDZ 224-015 possesses anti-COVID-19 activity, targeting Mpro (IC50 of 30 nM)[1][2].

  • CAS Number: 161511-45-1
  • MF: C30H35Cl2N3O9
  • MW: 652.52
  • Catalog: SARS-CoV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

4-Chlorosalicylic acid

4-Chlorosalicylic acid is a pharmaceutical intermediate. Inhibits monophenolase and diphenolase activity with IC50s of 1.89 mM and 1.10 mM. Potent antimicrobial activity. Against E. coli with the MIC of 250 μg/mL and with the MBC of 500 μg/mL.

  • CAS Number: 5106-98-9
  • MF: C7H5ClO3
  • MW: 172.566
  • Catalog: Bacterial
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 321.1±27.0 °C at 760 mmHg
  • Melting Point: 210-212 °C(lit.)
  • Flash Point: 148.0±23.7 °C

MEFLOQUINE

Mefloquine (Mefloquin), an orally active and potent quinoline antimalarial agent, is an anti-SARS-CoV-2 entry inhibitor. Mefloquine is also a K+ channel (KvQT1/minK) antagonist with an IC50 of ~1 μM. Mefloquine can be used for malaria, systemic lupus erythematosus and cancer research[1][2][3].

  • CAS Number: 53230-10-7
  • MF: C17H16F6N2O
  • MW: 378.31200
  • Catalog: SARS-CoV
  • Density: 1.383g/cm3
  • Boiling Point: 415.7ºC at 760mmHg
  • Melting Point: 242-244ºC
  • Flash Point: 205.2ºC

Actinomycin D

Actinomycin D inhibits DNA repair with an IC50 of 0.42 μM.

  • CAS Number: 50-76-0
  • MF: C62H86N12O16
  • MW: 1255.417
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 1386.0±65.0 °C at 760 mmHg
  • Melting Point: 251-253 °C
  • Flash Point: 792.1±34.3 °C

Temporin L

Temporin L is a potent antimicrobial peptide and is active against Gram-negative bacteria and yeast strains. Temporin L also has antiendotoxin properties[1][2].

  • CAS Number: 188713-81-7
  • MF: C83H122N20O15
  • MW: 1639.98
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

6-(1,3-dioxo-6-(piperidin-1-yl)-1H-benzo[de]isoquinolin-2(3H)-yl)hexanoic acid

NS1-IN-1 (compound 3) is a potent NS1 inhibitor. NS1 is a major influenza A virus virulence factor that inhibits host gene expression. NS1-IN-1 decreases viral protein levels, contributing to the reduction of virus replication. NS1-IN-1 shows antiviral activity by repressing the activity of mTORC1 in a TSC1-TSC2-dependent manner[1].

  • CAS Number: 181373-35-3
  • MF: C23H26N2O4
  • MW: 394.46400
  • Catalog: Influenza Virus
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ponazuril

Toltrazuril sulfone is an antiprotozoal agent that acts upon Coccidia parasites.IC50 Value:Target: AntiparasiticPonazuril (INN, Toltrazuril sulfone), sold by the Bayer Corporation under the trade name Marquis, is a drug currently approved for the treatment of equine protozoal myeloencephalitis in horses, caused by Sarcocystis neurona. More recently, veterinarians have been preparing a formulary version of the medication for use in small animals such as cats and dogs against coccidia, an intestinal parasite. Coccidia treatment is far shorter than treatment for EPM. Ponazuril (INN, Toltrazuril sulfone) is useful for Antiprotozoal.

  • CAS Number: 69004-04-2
  • MF: C18H14F3N3O6S
  • MW: 457.38000
  • Catalog: Parasite
  • Density: 1.507g/cm3
  • Boiling Point: N/A
  • Melting Point: 242°
  • Flash Point: N/A

Cephalonium

Cefalonium is the first-generation β-lactam cephalosporin antibiotic that is widely used to research bovine mastitis caused by Gram-positive bacteria including staphylococci[1][2][3].

  • CAS Number: 5575-21-3
  • MF: C20H18N4O5S2
  • MW: 458.51
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 147-150° (dec)
  • Flash Point: N/A

Lagociclovir valactate

Lagociclovir valactate is a prodrug of Lagociclovir (HY-14844). Lagociclovir valactate is an orally active anti-HBV agent[1].

  • CAS Number: 1001670-19-4
  • MF: C19H27FN6O6
  • MW: 454.45
  • Catalog: HBV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Diphyllin

Diphyllin is an arylnaphthalene lignan isolated from Justicia procumbens and is a potent HIV-1 inhibitor with an IC50 of 0.38 μM. Diphyllin is active against vesicular stomatitis virus (VSV) and influenza virus[1]. Diphyllin is a vacuolar type H+-ATPase (V-ATPase) inhibitor with an IC50 value of 17 nM and inhibits lysosomal acidification in human osteoclasts[2]. Diphyllin inhibits NO production with an IC50 of 50 μM and has anticancer and anti-inflammatory activities[3].

  • CAS Number: 22055-22-7
  • MF: C21H16O7
  • MW: 380.34800
  • Catalog: HIV
  • Density: 1.445g/cm3
  • Boiling Point: 638.8ºC at 760 mmHg
  • Melting Point: 290 ºC (methanol )
  • Flash Point: 232.4ºC

Eugenol

Eugenol is an essential oil found in cloves with antibacterial, anthelmintic and antioxidant activity. Eugenol is shown to inhibit lipid peroxidation.

  • CAS Number: 97-53-0
  • MF: C10H12O2
  • MW: 164.201
  • Catalog: Bacterial
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 255.0±0.0 °C at 760 mmHg
  • Melting Point: −12-−10 °C(lit.)
  • Flash Point: 119.8±8.1 °C

Gageotetrin B

Gageotetrin B has antimicrobial activities. Gageotetrin B is more active against fungi compared to bacteria with MIC values of 0.01-0.04 μM[1].

  • CAS Number: 1536405-81-8
  • MF: C38H70N4O9
  • MW: 726.98
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

JNJ4796

JNJ4796 is an oral active fusion inhibitor of influenza virus, neutralizing influenza A group 1 viruses by inhibiting hemagglutinin (HA)-mediated fusion. JNJ4796 mimics the functionality of the broadly neutralizing antibodies (bnAbs)[1].

  • CAS Number: 2241664-16-2
  • MF: C28H27N9O3
  • MW: 537.57
  • Catalog: Influenza Virus
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A