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BDBM50013144 CHEMBL2372584

SMILES: CCOP(O)(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)NCC(O)=O

InChI Key: InChIKey=FJOOVUXYFAXWST-NUTKFTJISA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50013144   
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))		BDBM50013144
PNG
(CHEMBL2372584)
Show SMILES CCOP(O)(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)NCC(O)=O |r|
Show InChI InChI=1S/C19H31N4O7P/c1-4-12(3)17(23-31(28,29)30-5-2)19(27)22-15(18(26)21-11-16(24)25)10-13-6-8-14(20)9-7-13/h6-9,12,15,17H,4-5,10-11,20H2,1-3H3,(H,21,26)(H,22,27)(H,24,25)(H2,23,28,29)/t12-,15-,17-/m0/s1
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Similars
PubMed
 1.90E+4n/an/an/an/an/an/a7.5n/a



University of Kentucky

Curated by ChEMBL


Assay Description
Assayed against human skin fibroblast Collagenase using the spectrophotometric assay with the thiol ester substrate at pH 6.5.

J Med Chem 33: 263-73 (1990)


BindingDB Entry DOI: 10.7270/Q2J9670V
More data for this
Ligand-Target Pair