BDBM50115182 (3-{2-[4-(3-o-Tolyl-ureido)-phenyl]-acetylamino}-benzoylamino)-acetic acid::CHEMBL317056

SMILES: Cc1ccccc1NC(=O)Nc1ccc(CC(=O)Nc2cccc(c2)C(=O)NCC(O)=O)cc1

InChI Key: InChIKey=VRIFJRKPGQZHJW-UHFFFAOYSA-N

Data: 1 IC50

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 = 50115182   

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
Fibronectin receptor beta/Integrin alpha-4 (Homo sapiens (Human))	BDBM50115182 ((3-{2-[4-(3-o-Tolyl-ureido)-phenyl]-acetylamino}-b...) Show SMILES Cc1ccccc1NC(=O)Nc1ccc(CC(=O)Nc2cccc(c2)C(=O)NCC(O)=O)cc1 Show InChI InChI=1S/C25H24N4O5/c1-16-5-2-3-8-21(16)29-25(34)28-19-11-9-17(10-12-19)13-22(30)27-20-7-4-6-18(14-20)24(33)26-15-23(31)32/h2-12,14H,13,15H2,1H3,(H,26,33)(H,27,30)(H,31,32)(H2,28,29,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Inc. Curated by ChEMBL					Assay Description Inhibition of Very late antigen 4 (VLA-4) and VCAM-Ig fusion protein interaction				J Med Chem 45: 2988-93 (2002) BindingDB Entry DOI: 10.7270/Q24J0GDJ
					More data for this Ligand-Target Pair