Details
Stereochemistry | ACHIRAL |
Molecular Formula | C22H16N2O5S |
Molecular Weight | 420.438 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC1=CC=C(C=C1O)C(=O)NC2=NC(=C(S2)C3=CC=CC=C3)C4=CC=C(O)C(O)=C4
InChI
InChIKey=LGGDLPSXAGQFSG-UHFFFAOYSA-N
InChI=1S/C22H16N2O5S/c25-15-8-6-13(10-17(15)27)19-20(12-4-2-1-3-5-12)30-22(23-19)24-21(29)14-7-9-16(26)18(28)11-14/h1-11,25-28H,(H,23,24,29)
Molecular Formula | C22H16N2O5S |
Molecular Weight | 420.438 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
COH-29 is an antimetabolite drug developed at City of Hope Cancer Center. Compound targets human ribonucleotide reductase, a key enzyme in the deoxyribonucleotide biosynthesis. In preclinical studies, COH-29 induced double-strand breaks in BRCA1-defective breast cancer cells and has been shown to reduce tumor growth in leukemia and ovarian cancer models. In 2015, COH-29 was licensed to a biotech company Novonco. The drug is being evaluated in phase 1 clinical trial for the treatment of patients with solid tumors.
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL1954 Sources: https://www.ncbi.nlm.nih.gov/pubmed/24072748 |
8.0 µM [IC50] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:02:56 GMT 2023
by
admin
on
Sat Dec 16 08:02:56 GMT 2023
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Record UNII |
07802BU06S
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Record Status |
Validated (UNII)
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Record Version |
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NCI_THESAURUS |
C2150
Created by
admin on Sat Dec 16 08:02:56 GMT 2023 , Edited by admin on Sat Dec 16 08:02:56 GMT 2023
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07802BU06S
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C114976
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44253415
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1190932-38-7
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admin on Sat Dec 16 08:02:56 GMT 2023 , Edited by admin on Sat Dec 16 08:02:56 GMT 2023
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TARGET -> INHIBITOR |
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ACTIVE MOIETY |