Compile Data Set for Download or QSAR

Found 106 hits with Last Name = 'saldanha' and Initial = 'sa'   

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
Collagenase 3 (Homo sapiens (Human))	BDBM16596 (4-N,6-N-bis[(4-fluoro-3-methylphenyl)methyl]pyrimi...) Show SMILES Cc1cc(CNC(=O)c2cc(ncn2)C(=O)NCc2ccc(F)c(C)c2)ccc1F Show InChI InChI=1S/C22H20F2N4O2/c1-13-7-15(3-5-17(13)23)10-25-21(29)19-9-20(28-12-27-19)22(30)26-11-16-4-6-18(24)14(2)8-16/h3-9,12H,10-11H2,1-2H3,(H,25,29)(H,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Florida Atlantic University Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli				Bioorg Med Chem 17: 990-1005 (2009) Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC
					More data for this Ligand-Target Pair				3D Structure (crystal)
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401576 (CHEMBL2207117) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc4ccccc4c3)c2=O)cc1 Show InChI InChI=1S/C21H15ClN2O3/c1-26-17-8-10-18(11-9-17)27-20-19(22)13-23-24(21(20)25)16-7-6-14-4-2-3-5-15(14)12-16/h2-13H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401572 (CHEMBL2207121) Show SMILES CCOc1ccc(Oc2c(Cl)cnn(-c3cc(C)cc(C)c3)c2=O)cc1 Show InChI InChI=1S/C20H19ClN2O3/c1-4-25-16-5-7-17(8-6-16)26-19-18(21)12-22-23(20(19)24)15-10-13(2)9-14(3)11-15/h5-12H,4H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401577 (CHEMBL2207531) Show SMILES CCc1cccc(c1)-n1ncc(Cl)c(Oc2ccc(OC)cc2)c1=O Show InChI InChI=1S/C19H17ClN2O3/c1-3-13-5-4-6-14(11-13)22-19(23)18(17(20)12-21-22)25-16-9-7-15(24-2)8-10-16/h4-12H,3H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75901 (5-chloranyl-2-(3,5-dimethylphenyl)-4-(4-methoxyphe...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cc(C)cc(C)c3)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O3/c1-12-8-13(2)10-14(9-12)22-19(23)18(17(20)11-21-22)25-16-6-4-15(24-3)5-7-16/h4-11H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75938 (5-chloranyl-4-(4-methoxyphenoxy)-2-(4-propan-2-ylp...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(cc3)C(C)C)c2=O)cc1 Show InChI InChI=1S/C20H19ClN2O3/c1-13(2)14-4-6-15(7-5-14)23-20(24)19(18(21)12-22-23)26-17-10-8-16(25-3)9-11-17/h4-13H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75900 (5-chloranyl-4-(4-methoxyphenoxy)-2-(3-propan-2-ylp...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(c3)C(C)C)c2=O)cc1 Show InChI InChI=1S/C20H19ClN2O3/c1-13(2)14-5-4-6-15(11-14)23-20(24)19(18(21)12-22-23)26-17-9-7-16(25-3)8-10-17/h4-13H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75918 (5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methyl-4-pro...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(C(C)C)c(C)c3)c2=O)cc1 Show InChI InChI=1S/C21H21ClN2O3/c1-13(2)18-10-5-15(11-14(18)3)24-21(25)20(19(22)12-23-24)27-17-8-6-16(26-4)7-9-17/h5-13H,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75923 (5-chloranyl-4-(4-methoxyphenoxy)-2-naphthalen-1-yl...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc4ccccc34)c2=O)cc1 Show InChI InChI=1S/C21H15ClN2O3/c1-26-15-9-11-16(12-10-15)27-20-18(22)13-23-24(21(20)25)19-8-4-6-14-5-2-3-7-17(14)19/h2-13H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75947 (5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methoxypheny...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(OC)c3)c2=O)cc1 Show InChI InChI=1S/C18H15ClN2O4/c1-23-13-6-8-14(9-7-13)25-17-16(19)11-20-21(18(17)22)12-4-3-5-15(10-12)24-2/h3-11H,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401571 (CHEMBL2207519) Show SMILES Cc1cc(C)cc(c1)-n1ncc(Cl)c(Oc2ccc(CO)cc2)c1=O Show InChI InChI=1S/C19H17ClN2O3/c1-12-7-13(2)9-15(8-12)22-19(24)18(17(20)10-21-22)25-16-5-3-14(11-23)4-6-16/h3-10,23H,11H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75917 (5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methylphenyl...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(C)c3)c2=O)cc1 Show InChI InChI=1S/C18H15ClN2O3/c1-12-4-3-5-13(10-12)21-18(22)17(16(19)11-20-21)24-15-8-6-14(23-2)7-9-15/h3-11H,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75896 (5-chloranyl-2-(4-ethylphenyl)-4-(4-methoxyphenoxy)...) Show SMILES CCc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(OC)cc2)c1=O Show InChI InChI=1S/C19H17ClN2O3/c1-3-13-4-6-14(7-5-13)22-19(23)18(17(20)12-21-22)25-16-10-8-15(24-2)9-11-16/h4-12H,3H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401579 (CHEMBL2207529) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(C)c(C)c3)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O3/c1-12-4-5-14(10-13(12)2)22-19(23)18(17(20)11-21-22)25-16-8-6-15(24-3)7-9-16/h4-11H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75904 (5-chloranyl-4-(4-methoxyphenoxy)-2-(5,6,7,8-tetrah...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc4CCCCc34)c2=O)cc1 Show InChI InChI=1S/C21H19ClN2O3/c1-26-15-9-11-16(12-10-15)27-20-18(22)13-23-24(21(20)25)19-8-4-6-14-5-2-3-7-17(14)19/h4,6,8-13H,2-3,5,7H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75899 (2-(4-butan-2-ylphenyl)-5-chloranyl-4-(4-methoxyphe...) Show SMILES CCC(C)c1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(OC)cc2)c1=O Show InChI InChI=1S/C21H21ClN2O3/c1-4-14(2)15-5-7-16(8-6-15)24-21(25)20(19(22)13-23-24)27-18-11-9-17(26-3)10-12-18/h5-14H,4H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75887 (5-chloranyl-4-[4-(hydroxymethyl)phenoxy]-2-(4-prop...) Show SMILES CC(C)c1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(CO)cc2)c1=O Show InChI InChI=1S/C20H19ClN2O3/c1-13(2)15-5-7-16(8-6-15)23-20(25)19(18(21)11-22-23)26-17-9-3-14(12-24)4-10-17/h3-11,13,24H,12H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75915 (5-chloranyl-4-(4-methoxyphenoxy)-2-(5,6,7,8-tetrah...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc4CCCCc4c3)c2=O)cc1 Show InChI InChI=1S/C21H19ClN2O3/c1-26-17-8-10-18(11-9-17)27-20-19(22)13-23-24(21(20)25)16-7-6-14-4-2-3-5-15(14)12-16/h6-13H,2-5H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75886 (5-chloranyl-4-(4-ethylphenoxy)-2-(4-methylphenyl)p...) Show SMILES CCc1ccc(Oc2c(Cl)cnn(-c3ccc(C)cc3)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O2/c1-3-14-6-10-16(11-7-14)24-18-17(20)12-21-22(19(18)23)15-8-4-13(2)5-9-15/h4-12H,3H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75898 (2-(4-tert-butylphenyl)-5-chloranyl-4-(4-methoxyphe...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(cc3)C(C)(C)C)c2=O)cc1 Show InChI InChI=1S/C21H21ClN2O3/c1-21(2,3)14-5-7-15(8-6-14)24-20(25)19(18(22)13-23-24)27-17-11-9-16(26-4)10-12-17/h5-13H,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401584 (CHEMBL2207524) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(Br)cc3)c2=O)cc1 Show InChI InChI=1S/C17H12BrClN2O3/c1-23-13-6-8-14(9-7-13)24-16-15(19)10-20-21(17(16)22)12-4-2-11(18)3-5-12/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75928 (5-chloranyl-2-(3-chlorophenyl)-4-(4-methoxyphenoxy...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(Cl)c3)c2=O)cc1 Show InChI InChI=1S/C17H12Cl2N2O3/c1-23-13-5-7-14(8-6-13)24-16-15(19)10-20-21(17(16)22)12-4-2-3-11(18)9-12/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401578 (CHEMBL2207530) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(Br)c3)c2=O)cc1 Show InChI InChI=1S/C17H12BrClN2O3/c1-23-13-5-7-14(8-6-13)24-16-15(19)10-20-21(17(16)22)12-4-2-3-11(18)9-12/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75891 (5-bromanyl-4-(4-methoxyphenoxy)-2-(4-propan-2-ylph...) Show SMILES COc1ccc(Oc2c(Br)cnn(-c3ccc(cc3)C(C)C)c2=O)cc1 Show InChI InChI=1S/C20H19BrN2O3/c1-13(2)14-4-6-15(7-5-14)23-20(24)19(18(21)12-22-23)26-17-10-8-16(25-3)9-11-17/h4-13H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75902 (5-bromanyl-4-(4-ethoxyphenoxy)-2-(4-propan-2-ylphe...) Show SMILES CCOc1ccc(Oc2c(Br)cnn(-c3ccc(cc3)C(C)C)c2=O)cc1 Show InChI InChI=1S/C21H21BrN2O3/c1-4-26-17-9-11-18(12-10-17)27-20-19(22)13-23-24(21(20)25)16-7-5-15(6-8-16)14(2)3/h5-14H,4H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401586 (CHEMBL2207522) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(cc3)C(F)(F)F)c2=O)cc1 Show InChI InChI=1S/C18H12ClF3N2O3/c1-26-13-6-8-14(9-7-13)27-16-15(19)10-23-24(17(16)25)12-4-2-11(3-5-12)18(20,21)22/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401585 (CHEMBL2207523) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(OC(C)C)cc3)c2=O)cc1 Show InChI InChI=1S/C20H19ClN2O4/c1-13(2)26-16-6-4-14(5-7-16)23-20(24)19(18(21)12-22-23)27-17-10-8-15(25-3)9-11-17/h4-13H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401570 (CHEMBL2207520) Show SMILES COc1ccc(Oc2c(Br)cnn(-c3ccc(C)cc3)c2=O)cc1 Show InChI InChI=1S/C18H15BrN2O3/c1-12-3-5-13(6-4-12)21-18(22)17(16(19)11-20-21)24-15-9-7-14(23-2)8-10-15/h3-11H,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	780	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75883 (5-chloranyl-2-(4-methylphenyl)-4-[4-(trifluorometh...) Show SMILES Cc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(cc2)C(F)(F)F)c1=O Show InChI InChI=1S/C18H12ClF3N2O2/c1-11-2-6-13(7-3-11)24-17(25)16(15(19)10-23-24)26-14-8-4-12(5-9-14)18(20,21)22/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50247214 (5-(3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl)...) Show SMILES Cc1nn(-c2ccccc2)c2sc(cc12)-c1nnc(S)o1 Show InChI InChI=1S/C14H10N4OS2/c1-8-10-7-11(12-15-16-14(20)19-12)21-13(10)18(17-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,16,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Florida Atlantic University Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli				Bioorg Med Chem 17: 990-1005 (2009) Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401580 (CHEMBL2207528) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(C)cc3C)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O3/c1-12-4-9-17(13(2)10-12)22-19(23)18(16(20)11-21-22)25-15-7-5-14(24-3)6-8-15/h4-11H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75878 (5-chloranyl-4-(4-ethoxyphenoxy)-2-(4-methylphenyl)...) Show SMILES CCOc1ccc(Oc2c(Cl)cnn(-c3ccc(C)cc3)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O3/c1-3-24-15-8-10-16(11-9-15)25-18-17(20)12-21-22(19(18)23)14-6-4-13(2)5-7-14/h4-12H,3H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75897 (5-chloranyl-2-(4-cyclopropylphenyl)-4-(4-methoxyph...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(cc3)C3CC3)c2=O)cc1 Show InChI InChI=1S/C20H17ClN2O3/c1-25-16-8-10-17(11-9-16)26-19-18(21)12-22-23(20(19)24)15-6-4-14(5-7-15)13-2-3-13/h4-13H,2-3H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75921 (4-[4-chloro-5-(4-methoxyphenoxy)-6-oxo-1-pyridazin...) Show SMILES CCOC(=O)c1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(OC)cc2)c1=O Show InChI InChI=1S/C20H17ClN2O5/c1-3-27-20(25)13-4-6-14(7-5-13)23-19(24)18(17(21)12-22-23)28-16-10-8-15(26-2)9-11-16/h4-12H,3H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401575 (CHEMBL2207118) Show SMILES Cc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(O)cc2)c1=O Show InChI InChI=1S/C17H13ClN2O3/c1-11-2-4-12(5-3-11)20-17(22)16(15(18)10-19-20)23-14-8-6-13(21)7-9-14/h2-10,21H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75920 (5-chloranyl-2-(2,3-dimethylphenyl)-4-(4-methoxyphe...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(C)c3C)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O3/c1-12-5-4-6-17(13(12)2)22-19(23)18(16(20)11-21-22)25-15-9-7-14(24-3)8-10-15/h4-11H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75919 (5-chloranyl-2-(2,5-dimethylphenyl)-4-(4-methoxyphe...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cc(C)ccc3C)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O3/c1-12-4-5-13(2)17(10-12)22-19(23)18(16(20)11-21-22)25-15-8-6-14(24-3)7-9-15/h4-11H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM29642 (4-[(5-thiophen-2-yl-2-thiophenyl)methylideneamino]...) Show SMILES Oc1ccc(cc1)\N=C\c1ccc(s1)-c1cccs1 Show InChI InChI=1S/C15H11NOS2/c17-12-5-3-11(4-6-12)16-10-13-7-8-15(19-13)14-2-1-9-18-14/h1-10,17H/b16-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Florida Atlantic University Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli				Bioorg Med Chem 17: 990-1005 (2009) Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401581 (CHEMBL2207527) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(cc3)-c3ccccc3)c2=O)cc1 Show InChI InChI=1S/C23H17ClN2O3/c1-28-19-11-13-20(14-12-19)29-22-21(24)15-25-26(23(22)27)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-15H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401583 (CHEMBL2207525) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(Cl)cc3)c2=O)cc1 Show InChI InChI=1S/C17H12Cl2N2O3/c1-23-13-6-8-14(9-7-13)24-16-15(19)10-20-21(17(16)22)12-4-2-11(18)3-5-12/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.77E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50247207 (2-(biphenyl-4-ylsulfonamido)pentanedioic acid | CH...) Show SMILES OC(=O)CCC(NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O Show InChI InChI=1S/C17H17NO6S/c19-16(20)11-10-15(17(21)22)18-25(23,24)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15,18H,10-11H2,(H,19,20)(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Florida Atlantic University Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli				Bioorg Med Chem 17: 990-1005 (2009) Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401592 (CHEMBL2207116) Show SMILES COc1ccc(Oc2c(Cl)c(OC)nn(-c3cccc(C)c3)c2=O)cc1 Show InChI InChI=1S/C19H17ClN2O4/c1-12-5-4-6-13(11-12)22-19(23)17(16(20)18(21-22)25-3)26-15-9-7-14(24-2)8-10-15/h4-11H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401573 (CHEMBL2207120) Show SMILES CC(C)c1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(cc2)C(=O)CN)c1=O Show InChI InChI=1S/C21H20ClN3O3/c1-13(2)14-3-7-16(8-4-14)25-21(27)20(18(22)12-24-25)28-17-9-5-15(6-10-17)19(26)11-23/h3-10,12-13H,11,23H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75884 (5-chloranyl-2-(4-methylphenyl)-4-[4-(trifluorometh...) Show SMILES Cc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(OC(F)(F)F)cc2)c1=O Show InChI InChI=1S/C18H12ClF3N2O3/c1-11-2-4-12(5-3-11)24-17(25)16(15(19)10-23-24)26-13-6-8-14(9-7-13)27-18(20,21)22/h2-10H,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM62088 (5-chloranyl-4-(4-methoxyphenoxy)-2-(4-methylphenyl...) Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3ccc(C)cc3)c2=O)cc1 Show InChI InChI=1S/C18H15ClN2O3/c1-12-3-5-13(6-4-12)21-18(22)17(16(19)11-20-21)24-15-9-7-14(23-2)8-10-15/h3-11H,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75880 (5-chloranyl-4-[4-(hydroxymethyl)phenoxy]-2-(4-meth...) Show SMILES Cc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(CO)cc2)c1=O Show InChI InChI=1S/C18H15ClN2O3/c1-12-2-6-14(7-3-12)21-18(23)17(16(19)10-20-21)24-15-8-4-13(11-22)5-9-15/h2-10,22H,11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75911 (4-(4-methoxyphenoxy)-2-p-cumenyl-5-vinyl-pyridazin...) Show SMILES COc1ccc(Oc2c(C=C)cnn(-c3ccc(cc3)C(C)C)c2=O)cc1 Show InChI InChI=1S/C22H22N2O3/c1-5-16-14-23-24(18-8-6-17(7-9-18)15(2)3)22(25)21(16)27-20-12-10-19(26-4)11-13-20/h5-15H,1H2,2-4H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50247209 (5-cyclohexyl-5-(2-(pyridin-4-yl)ethyl)pyrimidine-2...) Show SMILES O=C1NC(=O)C(CCc2ccncc2)(C2CCCCC2)C(=O)N1 Show InChI InChI=1S/C17H21N3O3/c21-14-17(13-4-2-1-3-5-13,15(22)20-16(23)19-14)9-6-12-7-10-18-11-8-12/h7-8,10-11,13H,1-6,9H2,(H2,19,20,21,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Florida Atlantic University Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli				Bioorg Med Chem 17: 990-1005 (2009) Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM50401582 (CHEMBL2207526) Show SMILES CCCCCc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(OC)cc2)c1=O Show InChI InChI=1S/C22H23ClN2O3/c1-3-4-5-6-16-7-9-17(10-8-16)25-22(26)21(20(23)15-24-25)28-19-13-11-18(27-2)12-14-19/h7-15H,3-6H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM75910 (5-(4-methoxyphenoxy)-6-oxo-1-(4-propan-2-ylphenyl)...) Show SMILES COC(=O)c1cnn(-c2ccc(cc2)C(C)C)c(=O)c1Oc1ccc(OC)cc1 Show InChI InChI=1S/C22H22N2O5/c1-14(2)15-5-7-16(8-6-15)24-21(25)20(19(13-23-24)22(26)28-4)29-18-11-9-17(27-3)10-12-18/h5-14H,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay				Bioorg Med Chem Lett 22: 7135-41 (2012) Article DOI: 10.1016/j.bmcl.2012.09.074 BindingDB Entry DOI: 10.7270/Q2WS8VDC
					More data for this Ligand-Target Pair

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