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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1200656
CHEMBL1200656
Compound Name NATAMYCIN
ChEMBL Synonyms E235 | Natacyn | CL-12625 | Antibiotic A-5283 | Natamycin | Pimaricin | Myprozine
Max Phase 4 (Approved)
Trade Names Natacyn | Myprozine | Pimaricin
Molecular Formula C33H47NO13

Additional synonyms for CHEMBL1200656 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C[C@@H]1C\C=C\C=C\C=C\C=C\[C@@H](C[C@@H]2O[C@](O)(C[C@@H](O) ...
Download SMILES
Standard InChI InChI=1S/C33H47NO13/c1-18-10-8-6-4-3-5-7-9-11-21(45-32-30(39 ...
Download InChI
Standard InChI Key NCXMLFZGDNKEPB-FFPOYIOWSA-N

Mechanism of Action

Mechanism of Action ChEMBL Target References
Ergosterol sequestering agent Ergosterol PubMed PubMed

Molecule Features

CHEMBL1200656 compound icon
Drug Type:Natural Product Rule of Five:N First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:N Parenteral:N Topical:Y Black Box:N Availability Type:Prescription-only

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 15 structural alerts for CHEMBL1200656. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL1200656

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL1200656. A 1uM and 10 uM cut-off have been applied to ChEMBL bioactivity data used to generate the respective models and the yellow coloured rows correspond to genuine predictions, i.e. targets not included in the original training set for this compound.


1uM


ChEMBL_ID Target Name Organism Score
CHEMBL3251 Nuclear factor NF-kappa-B p105 subunit Homo sapiens 1.000
CHEMBL4261 Hypoxia-inducible factor 1 alpha Homo sapiens 1.000
CHEMBL4176 Alpha-L-fucosidase I Homo sapiens 0.957
CHEMBL4931 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase Homo sapiens 0.950
CHEMBL1293237 Bloom syndrome protein Homo sapiens 0.884
CHEMBL2748 Sucrase-isomaltase Homo sapiens 0.881
CHEMBL3368 Glucocorticoid receptor Rattus norvegicus 0.841
CHEMBL2186 Carbonic anhydrase XIII Mus musculus 0.784
CHEMBL4372 Anthrax lethal factor Bacillus anthracis 0.310
CHEMBL4718 MAP kinase-interacting serine/threonine-protein kinase MNK1 Homo sapiens 0.217
CHEMBL5699 Serine/threonine-protein kinase SIK2 Homo sapiens 0.206



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL3014 Tyrosine-protein kinase SRC Rattus norvegicus 1.000
CHEMBL1697668 Solute carrier organic anion transporter family member 1B1 Homo sapiens 1.000
CHEMBL5845 Glycine receptor subunit alpha-1 Homo sapiens 1.000
CHEMBL5990 Breast cancer type 1 susceptibility protein Homo sapiens 1.000
CHEMBL1743121 Solute carrier organic anion transporter family member 1B3 Homo sapiens 1.000
CHEMBL2186 Carbonic anhydrase XIII Mus musculus 0.999
CHEMBL4176 Alpha-L-fucosidase I Homo sapiens 0.996
CHEMBL2885 Carbonic anhydrase III Homo sapiens 0.970
CHEMBL3384 Protein kinase N1 Homo sapiens 0.966
CHEMBL2748 Sucrase-isomaltase Homo sapiens 0.966
CHEMBL3251 Nuclear factor NF-kappa-B p105 subunit Homo sapiens 0.951
CHEMBL5784 NUAK family SNF1-like kinase 1 Homo sapiens 0.943
CHEMBL3368 Glucocorticoid receptor Rattus norvegicus 0.891
CHEMBL4931 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase Homo sapiens 0.850
CHEMBL1806 DNA topoisomerase II alpha Homo sapiens 0.839
CHEMBL5284 CaM-kinase kinase beta Homo sapiens 0.838
CHEMBL4954 Ephrin type-A receptor 3 Homo sapiens 0.807
CHEMBL5810 Ephrin type-A receptor 1 Homo sapiens 0.794
CHEMBL5432 Mitogen-activated protein kinase kinase kinase kinase 3 Homo sapiens 0.746
CHEMBL2074 Maltase-glucoamylase Homo sapiens 0.736

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
665.7 665.3047 -2.82 3 230.98 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
14 7 3 14 8 2


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
3.71 8.12 .88 -1.7 0 47 0.15

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A07 - ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE
A07A - INTESTINAL ANTIINFECTIVES
A07AA - Antibiotics
A07AA03 - natamycin

A - ALIMENTARY TRACT AND METABOLISM
A01 - STOMATOLOGICAL PREPARATIONS
A01A - STOMATOLOGICAL PREPARATIONS
A01AB - Antiinfectives and antiseptics for local oral treatment
A01AB10 - natamycin

G - GENITO URINARY SYSTEM AND SEX HORMONES
G01 - GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
G01A - ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS
G01AA - Antibiotics
G01AA02 - natamycin

S - SENSORY ORGANS
S01 - OPHTHALMOLOGICALS
S01A - ANTIINFECTIVES
S01AA - Antibiotics
S01AA10 - natamycin

D - DERMATOLOGICALS
D01 - ANTIFUNGALS FOR DERMATOLOGICAL USE
D01A - ANTIFUNGALS FOR TOPICAL USE
D01AA - Antibiotics
D01AA02 - natamycin

ChemSpider ChemSpider:NCXMLFZGDNKEPB-FFPOYIOWSA-N
DailyMed natamycin
PubChem SID: 144204112
Wikipedia Natamycin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1200656



ACToR 7681-93-8
BindingDB 50370755
DrugBank DB00826
eMolecules 530975 29534936
FDA SRS 8O0C852CPO
PubChem 5284447
PubChem: Thomson Pharma 14937174 14839501
SureChEMBL SCHEMBL18140

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/NCXMLFZGDNKEPB-FFPOYIOWSA-N spacer
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