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BDBM50013141 N-(Ethylphosphoryl)-L-isoleucyl-L-alanyl glycine-Gln-Arg-Gly

SMILES: CCOP([O-])(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O

InChI Key: InChIKey=GXSBARPPPVHXQZ-QHXHSKPESA-M

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50013141   
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))		BDBM50013141
PNG
(N-(Ethylphosphoryl)-L-isoleucyl-L-alanyl glycine-G...)
Show SMILES CCOP([O-])(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O
Show InChI InChI=1S/C26H49N10O11P/c1-5-14(3)21(36-48(45,46)47-6-2)25(44)33-15(4)22(41)31-12-19(38)34-17(9-10-18(27)37)24(43)35-16(8-7-11-30-26(28)29)23(42)32-13-20(39)40/h14-17,21H,5-13H2,1-4H3,(H2,27,37)(H,31,41)(H,32,42)(H,33,44)(H,34,38)(H,35,43)(H,39,40)(H4,28,29,30)(H2,36,45,46)/p-1/t14-,15-,16-,17-,21-/m0/s1
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Similars
PubMed
 4.60E+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