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BDBM50367925 CHEMBL2369491

SMILES: [K+].[K+].CCOP([O-])(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C([O-])=O

InChI Key: InChIKey=GLYKVJHLLDEIPB-CSFNDMPMSA-L

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50367925   
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))
BDBM50367925
PNG
(CHEMBL2369491)
Show SMILES [K+].[K+].CCOP([O-])(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C([O-])=O |r|
Show InChI InChI=1S/C19H37N4O8P.2K/c1-7-12(5)16(23-32(29,30)31-8-2)18(26)21-13(6)17(25)20-10-15(24)22-14(19(27)28)9-11(3)4;;/h11-14,16H,7-10H2,1-6H3,(H,20,25)(H,21,26)(H,22,24)(H,27,28)(H2,23,29,30);;/q;2*+1/p-2/t12-,13-,14-,16-;;/m0../s1
PDB
MMDB

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Similars

PubMed
2.40E+5n/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