BDBM50289390 (S)-3-(2-{3-[(Naphthalene-1-carbonyl)-amino]-2-oxo-2H-pyridin-1-yl}-acetylamino)-4-oxo-5-phenoxy-pentanoic acid::CHEMBL282408

SMILES: OC(=O)C[C@H](NC(=O)Cn1cccc(NC(=O)c2cccc3ccccc23)c1=O)C(=O)COc1ccccc1

InChI Key: InChIKey=RFEOZWTYAMRKSP-DEOSSOPVSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50289390   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Caspase-1 (Homo sapiens (Human))	BDBM50289390 ((S)-3-(2-{3-[(Naphthalene-1-carbonyl)-amino]-2-oxo...) Show SMILES OC(=O)C[C@H](NC(=O)Cn1cccc(NC(=O)c2cccc3ccccc23)c1=O)C(=O)COc1ccccc1 Show InChI InChI=1S/C29H25N3O7/c33-25(18-39-20-10-2-1-3-11-20)24(16-27(35)36)30-26(34)17-32-15-7-14-23(29(32)38)31-28(37)22-13-6-9-19-8-4-5-12-21(19)22/h1-15,24H,16-18H2,(H,30,34)(H,31,37)(H,35,36)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reversible inhibition of recombinant human IL-1 beta converting enzyme.				Bioorg Med Chem Lett 7: 1337-1342 (1997) Article DOI: 10.1016/S0960-894X(97)00220-5 BindingDB Entry DOI: 10.7270/Q2DN452C
					More data for this Ligand-Target Pair