Compile Data Set for Download or QSAR

Found 189 hits with Last Name = 'arora' and Initial = 'j'   

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
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50060429 ((R)-2-(4-Fluoro-phenyl)-2-{1-[3-(5-[1,2,4]triazol-...) Show SMILES OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C26H31FN6O/c27-21-5-3-19(4-6-21)26(16-34)31-22-9-12-32(13-10-22)11-1-2-20-15-28-25-8-7-23(14-24(20)25)33-17-29-30-18-33/h3-8,14-15,17-18,22,26,28,31,34H,1-2,9-13,16H2/t26-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136466 (CHEMBL343492 | Dimethyl-[2-(6-pyridin-3-yl-indol-1...) Show SMILES CN(C)CCn1ccc2ccc(cc12)-c1cccnc1 Show InChI InChI=1S/C17H19N3/c1-19(2)10-11-20-9-7-14-5-6-15(12-17(14)20)16-4-3-8-18-13-16/h3-9,12-13H,10-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152303 (CHEMBL361035 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-9-4-8-18(14-19)21-10-5-13-26-21)23-20-11-12-24(16-20)15-17-6-2-1-3-7-17/h1-10,13-14,20H,11-12,15-16H2,(H,23,25)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152303 (CHEMBL361035 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-9-4-8-18(14-19)21-10-5-13-26-21)23-20-11-12-24(16-20)15-17-6-2-1-3-7-17/h1-10,13-14,20H,11-12,15-16H2,(H,23,25)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50152314 ((S)-N-(1-benzylpyrrolidin-3-yl)-4-(thiophen-2-yl)b...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152306 (CHEMBL187122 | N-(1-Benzyl-pyrrolidin-3-yl)-4-thio...) Show SMILES O=C(NC1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-6-18(7-9-19)20-11-13-26-16-20)23-21-10-12-24(15-21)14-17-4-2-1-3-5-17/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152296 (CHEMBL364782 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-4-...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-6-18(7-9-19)20-11-13-26-16-20)23-21-10-12-24(15-21)14-17-4-2-1-3-5-17/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136469 (4-[1-(2-Dimethylamino-ethyl)-1H-indol-6-yl]-tetrah...) Show SMILES CN(C)CCn1ccc2ccc(cc12)C1(O)CCSCC1 Show InChI InChI=1S/C17H24N2OS/c1-18(2)9-10-19-8-5-14-3-4-15(13-16(14)19)17(20)6-11-21-12-7-17/h3-5,8,13,20H,6-7,9-12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152298 (CHEMBL426062 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-4-7-18(13-19)20-10-12-26-16-20)23-21-9-11-24(15-21)14-17-5-2-1-3-6-17/h1-8,10,12-13,16,21H,9,11,14-15H2,(H,23,25)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152305 (Biphenyl-4-carboxylic acid (1-benzyl-pyrrolidin-3-...) Show SMILES O=C(NC1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H24N2O/c27-24(22-13-11-21(12-14-22)20-9-5-2-6-10-20)25-23-15-16-26(18-23)17-19-7-3-1-4-8-19/h1-14,23H,15-18H2,(H,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152314 ((S)-N-(1-benzylpyrrolidin-3-yl)-4-(thiophen-2-yl)b...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152314 ((S)-N-(1-benzylpyrrolidin-3-yl)-4-(thiophen-2-yl)b...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152297 (CHEMBL187236 | N-(1-Benzyl-pyrrolidin-3-yl)-4-thio...) Show SMILES O=C(NC1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152302 (CHEMBL187113 | N-((R)-1-Benzyl-pyrrolidin-3-yl)-3-...) Show SMILES O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-4-7-18(13-19)20-10-12-26-16-20)23-21-9-11-24(15-21)14-17-5-2-1-3-6-17/h1-8,10,12-13,16,21H,9,11,14-15H2,(H,23,25)/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136462 (4-[1-(2-Dimethylamino-ethyl)-1H-indol-6-yl]-tetrah...) Show SMILES CN(C)CCn1ccc2ccc(cc12)C1(O)CCOCC1 Show InChI InChI=1S/C17H24N2O2/c1-18(2)9-10-19-8-5-14-3-4-15(13-16(14)19)17(20)6-11-21-12-7-17/h3-5,8,13,20H,6-7,9-12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136465 (CHEMBL343105 | Dimethyl-{2-[6-(tetrahydro-pyran-4-...) Show SMILES CN(C)CCn1ccc2ccc(cc12)C1CCOCC1 Show InChI InChI=1S/C17H24N2O/c1-18(2)9-10-19-8-5-15-3-4-16(13-17(15)19)14-6-11-20-12-7-14/h3-5,8,13-14H,6-7,9-12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174001 (CHEMBL381019 | N-[(S)-1-(4-Methyl-benzyl)-pyrrolid...) Show SMILES Cc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C23H24N2OS/c1-17-7-9-18(10-8-17)15-25-12-11-21(16-25)24-23(26)20-5-2-4-19(14-20)22-6-3-13-27-22/h2-10,13-14,21H,11-12,15-16H2,1H3,(H,24,26)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152309 (Biphenyl-3-carboxylic acid (1-benzyl-pyrrolidin-3-...) Show SMILES O=C(NC1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C24H24N2O/c27-24(22-13-7-12-21(16-22)20-10-5-2-6-11-20)25-23-14-15-26(18-23)17-19-8-3-1-4-9-19/h1-13,16,23H,14-15,17-18H2,(H,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136471 ((S)-1-{2-[4-(4-Carbamoyl-phenyl)-piperazin-1-yl]-e...) Show SMILES CNC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc(cc3)C(N)=O)OCCc2c1 Show InChI InChI=1S/C24H30N4O3/c1-26-24(30)19-4-7-21-18(16-19)9-15-31-22(21)8-10-27-11-13-28(14-12-27)20-5-2-17(3-6-20)23(25)29/h2-7,16,22H,8-15H2,1H3,(H2,25,29)(H,26,30)/t22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	4.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174000 ((S)-N-(1-(4-fluorobenzyl)pyrrolidin-3-yl)-4-(thiop...) Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C22H21FN2OS/c23-19-9-3-16(4-10-19)14-25-12-11-20(15-25)24-22(26)18-7-5-17(6-8-18)21-2-1-13-27-21/h1-10,13,20H,11-12,14-15H2,(H,24,26)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152311 (4''-Chloro-biphenyl-4-carboxylic acid (1-benzyl-py...) Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H23ClN2O/c25-22-12-10-20(11-13-22)19-6-8-21(9-7-19)24(28)26-23-14-15-27(17-23)16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136464 (CHEMBL138873 | Dimethyl-{2-[6-(tetrahydro-thiopyra...) Show SMILES CN(C)CCn1ccc2ccc(cc12)C1CCSCC1 Show InChI InChI=1S/C17H24N2S/c1-18(2)9-10-19-8-5-15-3-4-16(13-17(15)19)14-6-11-20-12-7-14/h3-5,8,13-14H,6-7,9-12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	5.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174006 ((S)-N-(1-(benzo[d][1,3]dioxol-5-ylmethyl)pyrrolidi...) Show SMILES O=C(N[C@H]1CCN(Cc2ccc3OCOc3c2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C23H22N2O3S/c26-23(18-6-4-17(5-7-18)22-2-1-11-29-22)24-19-9-10-25(14-19)13-16-3-8-20-21(12-16)28-15-27-20/h1-8,11-12,19H,9-10,13-15H2,(H,24,26)/t19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136468 (CHEMBL138821 | Dimethyl-[2-(6-thiophen-3-yl-indol-...) Show SMILES CN(C)CCn1ccc2ccc(cc12)-c1ccsc1 Show InChI InChI=1S/C16H18N2S/c1-17(2)8-9-18-7-5-13-3-4-14(11-16(13)18)15-6-10-19-12-15/h3-7,10-12H,8-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	7.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152310 (4''-Fluoro-biphenyl-4-carboxylic acid (1-benzyl-py...) Show SMILES Fc1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H23FN2O/c25-22-12-10-20(11-13-22)19-6-8-21(9-7-19)24(28)26-23-14-15-27(17-23)16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174008 ((S)-N-(1-(3,4-difluorobenzyl)pyrrolidin-3-yl)-4-(t...) Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1F Show InChI InChI=1S/C22H20F2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174011 ((S)-N-(1-(4-(trifluoromethyl)benzyl)pyrrolidin-3-y...) Show SMILES FC(F)(F)c1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C23H21F3N2OS/c24-23(25,26)19-9-3-16(4-10-19)14-28-12-11-20(15-28)27-22(29)18-7-5-17(6-8-18)21-2-1-13-30-21/h1-10,13,20H,11-12,14-15H2,(H,27,29)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50174000 ((S)-N-(1-(4-fluorobenzyl)pyrrolidin-3-yl)-4-(thiop...) Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C22H21FN2OS/c23-19-9-3-16(4-10-19)14-25-12-11-20(15-25)24-22(26)18-7-5-17(6-8-18)21-2-1-13-27-21/h1-10,13,20H,11-12,14-15H2,(H,24,26)/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174003 ((S)-N-(1-(3-methoxybenzyl)pyrrolidin-3-yl)-4-(thio...) Show SMILES COc1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1 Show InChI InChI=1S/C23H24N2O2S/c1-27-21-5-2-4-17(14-21)15-25-12-11-20(16-25)24-23(26)19-9-7-18(8-10-19)22-6-3-13-28-22/h2-10,13-14,20H,11-12,15-16H2,1H3,(H,24,26)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174010 ((S)-N-(1-(3,4-dichlorobenzyl)pyrrolidin-3-yl)-4-(t...) Show SMILES Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1Cl Show InChI InChI=1S/C22H20Cl2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50174008 ((S)-N-(1-(3,4-difluorobenzyl)pyrrolidin-3-yl)-4-(t...) Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1F Show InChI InChI=1S/C22H20F2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174004 (CHEMBL197381 | N-((S)-1-(4-chlorobenzyl)pyrrolidin...) Show SMILES Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C22H21ClN2OS/c23-19-8-6-16(7-9-19)14-25-11-10-20(15-25)24-22(26)18-4-1-3-17(13-18)21-5-2-12-27-21/h1-9,12-13,20H,10-11,14-15H2,(H,24,26)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152308 (4''-Methylsulfanyl-biphenyl-4-carboxylic acid (1-b...) Show SMILES CSc1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C25H26N2OS/c1-29-24-13-11-21(12-14-24)20-7-9-22(10-8-20)25(28)26-23-15-16-27(18-23)17-19-5-3-2-4-6-19/h2-14,23H,15-18H2,1H3,(H,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152313 (4''-Trifluoromethyl-biphenyl-4-carboxylic acid (1-...) Show SMILES FC(F)(F)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C25H23F3N2O/c26-25(27,28)22-12-10-20(11-13-22)19-6-8-21(9-7-19)24(31)29-23-14-15-30(17-23)16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,29,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152312 (3''-Fluoro-biphenyl-4-carboxylic acid (1-benzyl-py...) Show SMILES Fc1cccc(c1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H23FN2O/c25-22-8-4-7-21(15-22)19-9-11-20(12-10-19)24(28)26-23-13-14-27(17-23)16-18-5-2-1-3-6-18/h1-12,15,23H,13-14,16-17H2,(H,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152301 (CHEMBL366304 | N-((R)-1-Benzyl-pyrrolidin-3-yl)-4-...) Show SMILES O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-6-18(7-9-19)20-11-13-26-16-20)23-21-10-12-24(15-21)14-17-4-2-1-3-5-17/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25)/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174002 (CHEMBL370652 | N-((S)-1-(4-(trifluoromethyl)benzyl...) Show SMILES FC(F)(F)c1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C23H21F3N2OS/c24-23(25,26)19-8-6-16(7-9-19)14-28-11-10-20(15-28)27-22(29)18-4-1-3-17(13-18)21-5-2-12-30-21/h1-9,12-13,20H,10-11,14-15H2,(H,27,29)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174012 ((S)-N-(1-(3-(trifluoromethyl)benzyl)pyrrolidin-3-y...) Show SMILES FC(F)(F)c1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1 Show InChI InChI=1S/C23H21F3N2OS/c24-23(25,26)19-4-1-3-16(13-19)14-28-11-10-20(15-28)27-22(29)18-8-6-17(7-9-18)21-5-2-12-30-21/h1-9,12-13,20H,10-11,14-15H2,(H,27,29)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136467 (CHEMBL343712 | {2-[6-(3,6-Dihydro-2H-thiopyran-4-y...) Show SMILES CN(C)CCn1ccc2ccc(cc12)C1=CCSCC1 |t:16| Show InChI InChI=1S/C17H22N2S/c1-18(2)9-10-19-8-5-15-3-4-16(13-17(15)19)14-6-11-20-12-7-14/h3-6,8,13H,7,9-12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50174003 ((S)-N-(1-(3-methoxybenzyl)pyrrolidin-3-yl)-4-(thio...) Show SMILES COc1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1 Show InChI InChI=1S/C23H24N2O2S/c1-27-21-5-2-4-17(14-21)15-25-12-11-20(16-25)24-23(26)19-9-7-18(8-10-19)22-6-3-13-28-22/h2-10,13-14,20H,11-12,15-16H2,1H3,(H,24,26)/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50174010 ((S)-N-(1-(3,4-dichlorobenzyl)pyrrolidin-3-yl)-4-(t...) Show SMILES Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1Cl Show InChI InChI=1S/C22H20Cl2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152307 (CHEMBL186558 | N-((R)-1-Benzyl-pyrrolidin-3-yl)-4-...) Show SMILES O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152304 (3''-Amino-biphenyl-4-carboxylic acid (1-benzyl-pyr...) Show SMILES Nc1cccc(c1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H25N3O/c25-22-8-4-7-21(15-22)19-9-11-20(12-10-19)24(28)26-23-13-14-27(17-23)16-18-5-2-1-3-6-18/h1-12,15,23H,13-14,16-17,25H2,(H,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136463 (CHEMBL138462 | {2-[6-(3,6-Dihydro-2H-pyran-4-yl)-i...) Show SMILES CN(C)CCn1ccc2ccc(cc12)C1=CCOCC1 |t:16| Show InChI InChI=1S/C17H22N2O/c1-18(2)9-10-19-8-5-15-3-4-16(13-17(15)19)14-6-11-20-12-7-14/h3-6,8,13H,7,9-12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174009 ((S)-N-(1-(2-fluorobenzyl)pyrrolidin-3-yl)-4-(thiop...) Show SMILES Fc1ccccc1CN1CC[C@@H](C1)NC(=O)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H21FN2OS/c23-20-5-2-1-4-18(20)14-25-12-11-19(15-25)24-22(26)17-9-7-16(8-10-17)21-6-3-13-27-21/h1-10,13,19H,11-12,14-15H2,(H,24,26)/t19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50152299 (2''-Formyl-biphenyl-4-carboxylic acid (1-benzyl-py...) Show SMILES O=Cc1ccccc1-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C25H24N2O2/c28-18-22-8-4-5-9-24(22)20-10-12-21(13-11-20)25(29)26-23-14-15-27(17-23)16-19-6-2-1-3-7-19/h1-13,18,23H,14-17H2,(H,26,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells				Bioorg Med Chem Lett 14: 4847-50 (2004) Article DOI: 10.1016/j.bmcl.2004.07.045 BindingDB Entry DOI: 10.7270/Q20C4V7D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50174005 (CHEMBL373032 | N-((S)-1-(4-(trifluoromethoxy)benzy...) Show SMILES FC(F)(F)Oc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C23H21F3N2O2S/c24-23(25,26)30-20-8-6-16(7-9-20)14-28-11-10-19(15-28)27-22(29)18-4-1-3-17(13-18)21-5-2-12-31-21/h1-9,12-13,19H,10-11,14-15H2,(H,27,29)/t19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50136470 (CHEMBL139438 | Dimethyl-[2-(6-naphthalen-2-yl-indo...) Show SMILES CN(C)CCn1ccc2ccc(cc12)-c1ccc2ccccc2c1 Show InChI InChI=1S/C22H22N2/c1-23(2)13-14-24-12-11-18-8-10-21(16-22(18)24)20-9-7-17-5-3-4-6-19(17)15-20/h3-12,15-16H,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	57	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1D receptor expressed in Chinese hamster ovary cells (CHO cells)				Bioorg Med Chem Lett 13: 4409-13 (2003) BindingDB Entry DOI: 10.7270/Q2HT2NR1
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50174001 (CHEMBL381019 | N-[(S)-1-(4-Methyl-benzyl)-pyrrolid...) Show SMILES Cc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C23H24N2OS/c1-17-7-9-18(10-8-17)15-25-12-11-21(16-25)24-23(26)20-5-2-4-19(14-20)22-6-3-13-27-22/h2-10,13-14,21H,11-12,15-16H2,1H3,(H,24,26)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D2(short) receptor in rat pituitary GH4C1 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50152303 (CHEMBL361035 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...) Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-9-4-8-18(14-19)21-10-5-13-26-21)23-20-11-12-24(16-20)15-17-6-2-1-3-7-17/h1-10,13-14,20H,11-12,15-16H2,(H,23,25)/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D2(short) receptor in rat pituitary GH4C1 cells				Bioorg Med Chem Lett 15: 5253-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.051 BindingDB Entry DOI: 10.7270/Q26D5TSR
					More data for this Ligand-Target Pair

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