Compile Data Set for Download or QSAR

Found 16 hits Enz. Inhib. hit(s) with all data for entry = 50028945   

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))	BDBM50036750 (2-ethoxy-4-ethyl-5-[6-methyl-6-(2H-1,2,3,4-tetraaz...) Show SMILES CCOc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O Show InChI InChI=1S/C19H29N4O3/c1-5-14-12-17(25-6-2)15(24)13-16(14)26-11-9-7-8-10-19(3,4)18-20-22-23-21-18/h12-13H,5-11H2,1-4H3,(H-,20,21,22,23,24)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	14	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))	BDBM50280286 (4-ethyl-5-[6-methyl-6-(2H-1,2,3,4-tetraazol-5-yl)h...) Show SMILES CCCCCOc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O Show InChI InChI=1S/C22H35N4O3/c1-5-7-10-13-29-20-15-17(6-2)19(16-18(20)27)28-14-11-8-9-12-22(3,4)21-23-25-26-24-21/h15-16H,5-14H2,1-4H3,(H-,23,24,25,26,27)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	23	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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))	BDBM50280290 (4-ethyl-2-methoxy-5-[6-methyl-6-(2H-1,2,3,4-tetraa...) Show SMILES CCc1cc(OC)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C18H27N4O3/c1-5-13-11-16(24-4)14(23)12-15(13)25-10-8-6-7-9-18(2,3)17-19-21-22-20-17/h11-12H,5-10H2,1-4H3,(H-,19,20,21,22,23)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	25	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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))	BDBM50280287 (4-ethyl-2-isopropoxy-5-[6-methyl-6-(2H-1,2,3,4-tet...) Show SMILES CCc1cc(OC(C)C)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C20H31N4O3/c1-6-15-12-18(27-14(2)3)16(25)13-17(15)26-11-9-7-8-10-20(4,5)19-21-23-24-22-19/h12-14H,6-11H2,1-5H3,(H-,21,22,23,24,25)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	53	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))	BDBM50036749 (1-{5-ethyl-2-hydroxy-4-[6-methyl-6-(2H-1,2,3,4-tet...) Show SMILES CCc1cc(C(C)=O)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C19H28N4O3/c1-5-14-11-15(13(2)24)16(25)12-17(14)26-10-8-6-7-9-19(3,4)18-20-22-23-21-18/h11-12H,5-10H2,1-4H3,(H2,20,21,22,23,24,25)/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article	78	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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))	BDBM50280288 (4-ethyl-2-isopentyloxy-5-[6-methyl-6-(2H-1,2,3,4-t...) Show SMILES CCc1cc(OCCC(C)C)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C22H35N4O3/c1-6-17-14-20(29-13-10-16(2)3)18(27)15-19(17)28-12-9-7-8-11-22(4,5)21-23-25-26-24-21/h14-16H,6-13H2,1-5H3,(H-,23,24,25,26,27)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	83	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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	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))	BDBM50280289 (4-ethyl-2-(4-fluorobenzyloxy)-5-[6-methyl-6-(2H-1,...) Show SMILES CCc1cc(OCc2ccc(F)cc2)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C24H30FN4O3/c1-4-18-14-22(32-16-17-8-10-19(25)11-9-17)20(30)15-21(18)31-13-7-5-6-12-24(2,3)23-26-28-29-27-23/h8-11,14-15H,4-7,12-13,16H2,1-3H3,(H-,26,27,28,29,30)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	110	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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))	BDBM50036750 (2-ethoxy-4-ethyl-5-[6-methyl-6-(2H-1,2,3,4-tetraaz...) Show SMILES CCOc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O Show InChI InChI=1S/C19H29N4O3/c1-5-14-12-17(25-6-2)15(24)13-16(14)26-11-9-7-8-10-19(3,4)18-20-22-23-21-18/h12-13H,5-11H2,1-4H3,(H-,20,21,22,23,24)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.80	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))	BDBM50280290 (4-ethyl-2-methoxy-5-[6-methyl-6-(2H-1,2,3,4-tetraa...) Show SMILES CCc1cc(OC)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C18H27N4O3/c1-5-13-11-16(24-4)14(23)12-15(13)25-10-8-6-7-9-18(2,3)17-19-21-22-20-17/h11-12H,5-10H2,1-4H3,(H-,19,20,21,22,23)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	6	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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))	BDBM50280286 (4-ethyl-5-[6-methyl-6-(2H-1,2,3,4-tetraazol-5-yl)h...) Show SMILES CCCCCOc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O Show InChI InChI=1S/C22H35N4O3/c1-5-7-10-13-29-20-15-17(6-2)19(16-18(20)27)28-14-11-8-9-12-22(3,4)21-23-25-26-24-21/h15-16H,5-14H2,1-4H3,(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	6.60	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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))	BDBM50280287 (4-ethyl-2-isopropoxy-5-[6-methyl-6-(2H-1,2,3,4-tet...) Show SMILES CCc1cc(OC(C)C)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C20H31N4O3/c1-6-15-12-18(27-14(2)3)16(25)13-17(15)26-11-9-7-8-10-20(4,5)19-21-23-24-22-19/h12-14H,6-11H2,1-5H3,(H-,21,22,23,24,25)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	12	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))	BDBM50280289 (4-ethyl-2-(4-fluorobenzyloxy)-5-[6-methyl-6-(2H-1,...) Show SMILES CCc1cc(OCc2ccc(F)cc2)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C24H30FN4O3/c1-4-18-14-22(32-16-17-8-10-19(25)11-9-17)20(30)15-21(18)31-13-7-5-6-12-24(2,3)23-26-28-29-27-23/h8-11,14-15H,4-7,12-13,16H2,1-3H3,(H-,26,27,28,29,30)/q-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	31	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))	BDBM50280288 (4-ethyl-2-isopentyloxy-5-[6-methyl-6-(2H-1,2,3,4-t...) Show SMILES CCc1cc(OCCC(C)C)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C22H35N4O3/c1-6-17-14-20(29-13-10-16(2)3)18(27)15-19(17)28-12-9-7-8-11-22(4,5)21-23-25-26-24-21/h14-16H,6-13H2,1-5H3,(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	36	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
Leukotriene B4 receptor 1 (Homo sapiens (Human))	BDBM50036749 (1-{5-ethyl-2-hydroxy-4-[6-methyl-6-(2H-1,2,3,4-tet...) Show SMILES CCc1cc(C(C)=O)c(O)cc1OCCCCCC(C)(C)c1nn[n-]n1 Show InChI InChI=1S/C19H28N4O3/c1-5-14-11-15(13(2)24)16(25)12-17(14)26-10-8-6-7-9-19(3,4)18-20-22-23-21-18/h11-12H,5-10H2,1-4H3,(H2,20,21,22,23,24,25)/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	85	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 binding to Leukotriene B4 receptor in guinea pig lung membrane binding assa...				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