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SMILES: CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@@H](CCN1C(=O)c2cccc3cccc(C1=O)c23)P(O)(O)=O

InChI Key: InChIKey=KUVXVNIOOYCQJJ-KKUQBAQOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50283785   
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))		BDBM50283785
PNG
(CHEMBL98233 | {(R)-3-(1,3-Dioxo-1H,3H-benzo[de]iso...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@@H](CCN1C(=O)c2cccc3cccc(C1=O)c23)P(O)(O)=O
Show InChI InChI=1S/C31H37N4O7P/c1-19(2)17-24(29(37)34-25(28(36)32-3)18-20-9-5-4-6-10-20)33-26(43(40,41)42)15-16-35-30(38)22-13-7-11-21-12-8-14-23(27(21)22)31(35)39/h4-14,19,24-26,33H,15-18H2,1-3H3,(H,32,36)(H,34,37)(H2,40,41,42)/t24-,25-,26+/m0/s1
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Article
n/an/a 30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human fibroblast collagenase

Bioorg Med Chem Lett 4: 2833-2836 (1994)


Article DOI: 10.1016/S0960-894X(01)80823-4
BindingDB Entry DOI: 10.7270/Q2HH6K16
More data for this
Ligand-Target Pair