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SMILES: CC(C)C[C@H](CP(O)([O-])=CNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C([O-])=O

InChI Key: InChIKey=NDJIIOVEMDNXIM-MOPGFXCFSA-M

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50121452   
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
Thermolysin


(Bacillus thermoproteolyticus)		BDBM50121452
PNG
((S)-2-{(S)-2-[(Benzyloxycarbonylamino-methyl)-hydr...)
Show SMILES CC(C)C[C@H](CP(O)([O-])=CNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C([O-])=O
Show InChI InChI=1S/C22H34N2O7P/c1-15(2)10-18(20(25)24-19(21(26)27)11-16(3)4)13-32(29,30)14-23-22(28)31-12-17-8-6-5-7-9-17/h5-9,14-16,18-19H,10-13H2,1-4H3,(H4-,23,24,25,26,27,28,29,30)/q-1/p-1/t18-,19+/m1/s1
PDB
MMDB

UniProtKB/SwissProt

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GoogleScholar
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PC cid
PC sid
UniChem
PubMed
 11n/an/an/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Competitive inhibition of thermolysin evaluated using the substrate FAGLA (Sigma); Competitive binding observed

Bioorg Med Chem Lett 12: 3625-7 (2002)


BindingDB Entry DOI: 10.7270/Q269744P
More data for this
Ligand-Target Pair