BDBM50152781 (S)-2-((1S,4R)-7,7-Dimethyl-2-oxo-bicyclo[2.2.1]hept-1-ylmethanesulfonylamino)-9-(5,6,7,8-tetrahydro-[1,8]naphthyridin-2-yl)-nonanoic acid::CHEMBL185031

SMILES: CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N[C@@H](CCCCCCCc1ccc3CCCNc3n1)C(O)=O)C(=O)C2

InChI Key: InChIKey=SDUQEHZORCVRMT-SBQVMTCPSA-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 = 50152781   

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
ITGAV/ITGB3 (Homo sapiens (Human))	BDBM50152781 ((S)-2-((1S,4R)-7,7-Dimethyl-2-oxo-bicyclo[2.2.1]he...) Show SMILES CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N[C@@H](CCCCCCCc1ccc3CCCNc3n1)C(O)=O)C(=O)C2 |TLB:34:33:1:5.4| Show InChI InChI=1S/C27H41N3O5S/c1-26(2)20-14-15-27(26,23(31)17-20)18-36(34,35)30-22(25(32)33)11-7-5-3-4-6-10-21-13-12-19-9-8-16-28-24(19)29-21/h12-13,20,22,30H,3-11,14-18H2,1-2H3,(H,28,29)(H,32,33)/t20-,22+,27-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding to alpha v beta 3 receptor				Bioorg Med Chem Lett 14: 4411-5 (2004) Article DOI: 10.1016/j.bmcl.2004.06.068 BindingDB Entry DOI: 10.7270/Q2PZ5B0H
					More data for this Ligand-Target Pair