BDBM50297738 (R)-1-(3-(3,4-dioxo-2-(1-phenylpropylamino)cyclobut-1-enylamino)-2-hydroxybenzoyl)pyrrolidine-2-carboxylic acid::CHEMBL556862

SMILES: CC[C@@H](Nc1c(Nc2cccc(C(=O)N3CCCC3C(O)=O)c2O)c(=O)c1=O)c1ccccc1

InChI Key: InChIKey=UDJPTWYRKLFZEK-PYUWXLGESA-N

Data: 2 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 2 hits for monomerid = 50297738   

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
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50297738 ((R)-1-(3-(3,4-dioxo-2-(1-phenylpropylamino)cyclobu...) Show SMILES CC[C@@H](Nc1c(Nc2cccc(C(=O)N3CCCC3C(O)=O)c2O)c(=O)c1=O)c1ccccc1 |r| Show InChI InChI=1S/C25H25N3O6/c1-2-16(14-8-4-3-5-9-14)26-19-20(23(31)22(19)30)27-17-11-6-10-15(21(17)29)24(32)28-13-7-12-18(28)25(33)34/h3-6,8-11,16,18,26-27,29H,2,7,12-13H2,1H3,(H,33,34)/t16-,18?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of human [125I]IL-8 from human CXCR2				Bioorg Med Chem Lett 19: 4446-9 (2009) Article DOI: 10.1016/j.bmcl.2009.05.049 BindingDB Entry DOI: 10.7270/Q2H1323X
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM50297738 ((R)-1-(3-(3,4-dioxo-2-(1-phenylpropylamino)cyclobu...) Show SMILES CC[C@@H](Nc1c(Nc2cccc(C(=O)N3CCCC3C(O)=O)c2O)c(=O)c1=O)c1ccccc1 |r| Show InChI InChI=1S/C25H25N3O6/c1-2-16(14-8-4-3-5-9-14)26-19-20(23(31)22(19)30)27-17-11-6-10-15(21(17)29)24(32)28-13-7-12-18(28)25(33)34/h3-6,8-11,16,18,26-27,29H,2,7,12-13H2,1H3,(H,33,34)/t16-,18?/m1/s1	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of human [125I]IL-8 from human CXCR1				Bioorg Med Chem Lett 19: 4446-9 (2009) Article DOI: 10.1016/j.bmcl.2009.05.049 BindingDB Entry DOI: 10.7270/Q2H1323X
					More data for this Ligand-Target Pair