BDBM50130105 (R)-2-[Benzo[1,3]dioxol-5-ylmethyl-(4-methoxy-benzenesulfonyl)-amino]-pentanedioic acid 5-[benzyl-(2-cyano-ethyl)-amide] 1-hydroxyamide::CHEMBL308221

SMILES: COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCC(=O)N(CCC#N)Cc1ccccc1)C(=O)NO

InChI Key: InChIKey=ZTPILGZHTKPAJG-AREMUKBSSA-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 = 50130105   

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
Bone morphogenetic protein 1 (Homo sapiens (Human))	BDBM50130105 ((R)-2-[Benzo[1,3]dioxol-5-ylmethyl-(4-methoxy-benz...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCC(=O)N(CCC#N)Cc1ccccc1)C(=O)NO Show InChI InChI=1S/C30H32N4O8S/c1-40-24-9-11-25(12-10-24)43(38,39)34(20-23-8-14-27-28(18-23)42-21-41-27)26(30(36)32-37)13-15-29(35)33(17-5-16-31)19-22-6-3-2-4-7-22/h2-4,6-12,14,18,26,37H,5,13,15,17,19-21H2,1H3,(H,32,36)/t26-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CombiChem Inc. Curated by ChEMBL					Assay Description Ability to inhibit procollagen C-terminal proteinase (PCP) tested in vitro				Bioorg Med Chem Lett 13: 2381-4 (2003) BindingDB Entry DOI: 10.7270/Q26H4GS8
					More data for this Ligand-Target Pair