Compile Data Set for Download or QSAR

Found 18 hits with Last Name = 'mcelvaine' and Initial = 'm'   

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
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21692 (1-(4-chlorophenyl)-3-[1-methyl-3-oxo-2-phenyl-5-(p...) Show SMILES CC(C)c1c(NC(=O)Nc2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C Show InChI InChI=1S/C20H21ClN4O2/c1-13(2)18-17(23-20(27)22-15-11-9-14(21)10-12-15)19(26)25(24(18)3)16-7-5-4-6-8-16/h4-13H,1-3H3,(H2,22,23,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	44	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair				3D Structure (crystal)
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21709 (2-ethyl-1-[(3R)-1-[(5-methoxy-1H-1,3-benzodiazol-2...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1nc2ccc(OC)cc2[nH]1 |r| Show InChI InChI=1S/C22H23N5O2/c1-3-20-23-17-6-4-5-7-19(17)27(20)14-10-11-26(13-14)22(28)21-24-16-9-8-15(29-2)12-18(16)25-21/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,24,25)/t14-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.87E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21694 (1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...) Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O Show InChI InChI=1S/C22H22N4O3/c1-29-16-6-7-17-14(12-16)13-19(23-17)21(27)25-10-8-15(9-11-25)26-20-5-3-2-4-18(20)24-22(26)28/h2-7,12-13,15,23H,8-11H2,1H3,(H,24,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	6.39E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21695 (1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...) Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1cnc2ccccc12 Show InChI InChI=1S/C22H22N4O2/c1-28-17-6-7-18-15(12-17)13-20(24-18)22(27)25-10-8-16(9-11-25)26-14-23-19-4-2-3-5-21(19)26/h2-7,12-14,16,24H,8-11H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.10E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21696 (1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...) Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(C)nc2ccccc12 Show InChI InChI=1S/C23H24N4O2/c1-15-24-20-5-3-4-6-22(20)27(15)17-9-11-26(12-10-17)23(28)21-14-16-13-18(29-2)7-8-19(16)25-21/h3-8,13-14,17,25H,9-12H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.02E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21697 (2-ethyl-1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]pi...) Show SMILES CCc1nc2ccccc2n1C1CCN(CC1)C(=O)c1cc2cc(OC)ccc2[nH]1 Show InChI InChI=1S/C24H26N4O2/c1-3-23-26-20-6-4-5-7-22(20)28(23)17-10-12-27(13-11-17)24(29)21-15-16-14-18(30-2)8-9-19(16)25-21/h4-9,14-15,17,25H,3,10-13H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	690	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21698 (1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...) Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(CC(C)C)nc2ccccc12 Show InChI InChI=1S/C26H30N4O2/c1-17(2)14-25-28-22-6-4-5-7-24(22)30(25)19-10-12-29(13-11-19)26(31)23-16-18-15-20(32-3)8-9-21(18)27-23/h4-9,15-17,19,27H,10-14H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	830	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21699 (1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...) Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(nc2ccccc12)C(F)(F)F Show InChI InChI=1S/C23H21F3N4O2/c1-32-16-6-7-17-14(12-16)13-19(27-17)21(31)29-10-8-15(9-11-29)30-20-5-3-2-4-18(20)28-22(30)23(24,25)26/h2-7,12-13,15,27H,8-11H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.52E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21700 (1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...) Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(nc2ccccc12)-c1ccccc1 Show InChI InChI=1S/C28H26N4O2/c1-34-22-11-12-23-20(17-22)18-25(29-23)28(33)31-15-13-21(14-16-31)32-26-10-6-5-9-24(26)30-27(32)19-7-3-2-4-8-19/h2-12,17-18,21,29H,13-16H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.71E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21701 (2-ethyl-1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]py...) Show SMILES CCc1nc2ccccc2n1C1CCN(C1)C(=O)c1cc2cc(OC)ccc2[nH]1 Show InChI InChI=1S/C23H24N4O2/c1-3-22-25-19-6-4-5-7-21(19)27(22)16-10-11-26(14-16)23(28)20-13-15-12-17(29-2)8-9-18(15)24-20/h4-9,12-13,16,24H,3,10-11,14H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	130	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21702 (2-ethyl-1-[(3R)-1-[(5-methoxy-1H-indol-2-yl)carbon...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(OC)ccc2[nH]1 |r| Show InChI InChI=1S/C23H24N4O2/c1-3-22-25-19-6-4-5-7-21(19)27(22)16-10-11-26(14-16)23(28)20-13-15-12-17(29-2)8-9-18(15)24-20/h4-9,12-13,16,24H,3,10-11,14H2,1-2H3/t16-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	34	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21703 (2-ethyl-1-[(3S)-1-[(5-methoxy-1H-indol-2-yl)carbon...) Show SMILES CCc1nc2ccccc2n1[C@H]1CCN(C1)C(=O)c1cc2cc(OC)ccc2[nH]1 |r| Show InChI InChI=1S/C23H24N4O2/c1-3-22-25-19-6-4-5-7-21(19)27(22)16-10-11-26(14-16)23(28)20-13-15-12-17(29-2)8-9-18(15)24-20/h4-9,12-13,16,24H,3,10-11,14H2,1-2H3/t16-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.50E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21704 (2-ethyl-1-[(3R)-1-[(5-fluoro-1H-indol-2-yl)carbony...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(F)ccc2[nH]1 |r| Show InChI InChI=1S/C22H21FN4O/c1-2-21-25-18-5-3-4-6-20(18)27(21)16-9-10-26(13-16)22(28)19-12-14-11-15(23)7-8-17(14)24-19/h3-8,11-12,16,24H,2,9-10,13H2,1H3/t16-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.49E+3	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21705 (1-[(3R)-1-[(5-chloro-1H-indol-2-yl)carbonyl]pyrrol...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(Cl)ccc2[nH]1 |r| Show InChI InChI=1S/C22H21ClN4O/c1-2-21-25-18-5-3-4-6-20(18)27(21)16-9-10-26(13-16)22(28)19-12-14-11-15(23)7-8-17(14)24-19/h3-8,11-12,16,24H,2,9-10,13H2,1H3/t16-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.41E+4	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21706 (1-[(3R)-1-[(5-bromo-1H-indol-2-yl)carbonyl]pyrroli...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(Br)ccc2[nH]1 |r| Show InChI InChI=1S/C22H21BrN4O/c1-2-21-25-18-5-3-4-6-20(18)27(21)16-9-10-26(13-16)22(28)19-12-14-11-15(23)7-8-17(14)24-19/h3-8,11-12,16,24H,2,9-10,13H2,1H3/t16-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	810	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21707 (2-ethyl-1-[(3R)-1-{[5-(trifluoromethoxy)-1H-indol-...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1 |r| Show InChI InChI=1S/C23H21F3N4O2/c1-2-21-28-18-5-3-4-6-20(18)30(21)15-9-10-29(13-15)22(31)19-12-14-11-16(32-23(24,25)26)7-8-17(14)27-19/h3-8,11-12,15,27H,2,9-10,13H2,1H3/t15-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.22E+4	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21708 (2-ethyl-1-[(3R)-1-[(5-ethyl-1H-indol-2-yl)carbonyl...) Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(CC)ccc2[nH]1 |r| Show InChI InChI=1S/C24H26N4O/c1-3-16-9-10-19-17(13-16)14-21(25-19)24(29)27-12-11-18(15-27)28-22-8-6-5-7-20(22)26-23(28)4-2/h5-10,13-14,18,25H,3-4,11-12,15H2,1-2H3/t18-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	270	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair
N-formyl peptide receptor 2 (Homo sapiens (Human))	BDBM21693 (1-(2-chlorophenyl)-3-[1-methyl-3-oxo-2-phenyl-5-(p...) Show SMILES CC(C)c1c(NC(=O)Nc2ccccc2Cl)c(=O)n(-c2ccccc2)n1C Show InChI InChI=1S/C20H21ClN4O2/c1-13(2)18-17(23-20(27)22-16-12-8-7-11-15(16)21)19(26)25(24(18)3)14-9-5-4-6-10-14/h4-13H,1-3H3,(H2,22,23,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	7.2	37
Amgen					Assay Description hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...				Bioorg Med Chem Lett 17: 6633-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.043 BindingDB Entry DOI: 10.7270/Q25H7DJ4
					More data for this Ligand-Target Pair