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SMILES: CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)[C@H](CC(=O)OC)SC(C)=O

InChI Key: InChIKey=JZEPIVKJGNYWHP-GIVPXCGWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50043242   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Interstitial collagenase


(Homo sapiens (Human))		BDBM50043242
PNG
(3-Acetylsulfanyl-4-[2-(1H-indol-3-yl)-1-methylcarb...)
Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)[C@H](CC(=O)OC)SC(C)=O
Show InChI InChI=1S/C24H33N3O5S/c1-14(2)10-18(21(33-15(3)28)12-22(29)32-5)23(30)27-20(24(31)25-4)11-16-13-26-19-9-7-6-8-17(16)19/h6-9,13-14,18,20-21,26H,10-12H2,1-5H3,(H,25,31)(H,27,30)/t18-,20+,21+/m1/s1
PDB
MMDB

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PubMed
n/an/a 19n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase

J Med Chem 36: 4030-9 (1994)


BindingDB Entry DOI: 10.7270/Q2028QM3
More data for this
Ligand-Target Pair