Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Leukotriene B4 receptor 1' and Ligand = 'BDBM50280285'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Leukotriene B4 receptor 1 (Homo sapiens (Human))	BDBM50280285 (2-cyclopentyloxy-4-ethyl-5-[6-methyl-6-(2H-1,2,3,4...) Show SMILES CCc1cc(OC2CCCC2)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C22H33N4O3/c1-4-16-14-20(29-17-10-6-7-11-17)18(27)15-19(16)28-13-9-5-8-12-22(2,3)21-23-25-26-24-21/h14-15,17H,4-13H2,1-3H3,(H-,23,24,25,26,27)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	109	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for receptor binding against [3H]-LTB4 radioligand to Leukotriene B4 receptor in human neutrophil binding assay				Bioorg Med Chem Lett 2: 1669-1674 (1992) Article DOI: 10.1016/S0960-894X(00)80453-9 BindingDB Entry DOI: 10.7270/Q2PN95KG
					More data for this Ligand-Target Pair
Leukotriene B4 receptor 1 (Homo sapiens (Human))	BDBM50280285 (2-cyclopentyloxy-4-ethyl-5-[6-methyl-6-(2H-1,2,3,4...) Show SMILES CCc1cc(OC2CCCC2)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C22H33N4O3/c1-4-16-14-20(29-17-10-6-7-11-17)18(27)15-19(16)28-13-9-5-8-12-22(2,3)21-23-25-26-24-21/h14-15,17H,4-13H2,1-3H3,(H-,23,24,25,26,27)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for receptor binding against [3H]-LTB4 radioligand to Leukotriene B4 receptor in human neutrophil binding assay				Bioorg Med Chem Lett 2: 1669-1674 (1992) Article DOI: 10.1016/S0960-894X(00)80453-9 BindingDB Entry DOI: 10.7270/Q2PN95KG
					More data for this Ligand-Target Pair