null

SMILES: CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1

InChI Key: InChIKey=MNXNYFBCTGEMEN-IYARVYRRSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50207142   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50207142 (CHEMBL3973487) Show SMILES CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:4.3,wD:7.7,(11.77,-25.1,;13.32,-25.2,;14.03,-26.59,;14.08,-23.86,;15.63,-23.86,;16.4,-22.52,;17.94,-22.52,;18.71,-23.86,;20.25,-23.86,;21.02,-22.52,;22.56,-22.52,;23.33,-23.86,;24.87,-23.86,;25.64,-22.52,;24.87,-21.19,;23.33,-21.19,;27.19,-22.52,;28.11,-23.76,;29.55,-23.3,;29.55,-21.75,;30.73,-20.73,;30.37,-19.25,;28.93,-18.79,;27.8,-19.82,;28.11,-21.3,;17.94,-25.2,;16.4,-25.2,)| Show InChI InChI=1S/C21H30N4OS/c1-16(26)22-18-8-6-17(7-9-18)10-11-24-12-14-25(15-13-24)21-19-4-2-3-5-20(19)27-23-21/h2-5,17-18H,6-15H2,1H3,(H,22,26)/t17-,18-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Displacement of [3H]methyl-spiperone from recombinant human D3 receptor expressed in CHO cell membranes after 60 mins by scintillation counting metho...				Eur J Med Chem 123: 332-353 (2016) Article DOI: 10.1016/j.ejmech.2016.07.038 BindingDB Entry DOI: 10.7270/Q2GH9KXP
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50207142 (CHEMBL3973487) Show SMILES CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:4.3,wD:7.7,(11.77,-25.1,;13.32,-25.2,;14.03,-26.59,;14.08,-23.86,;15.63,-23.86,;16.4,-22.52,;17.94,-22.52,;18.71,-23.86,;20.25,-23.86,;21.02,-22.52,;22.56,-22.52,;23.33,-23.86,;24.87,-23.86,;25.64,-22.52,;24.87,-21.19,;23.33,-21.19,;27.19,-22.52,;28.11,-23.76,;29.55,-23.3,;29.55,-21.75,;30.73,-20.73,;30.37,-19.25,;28.93,-18.79,;27.8,-19.82,;28.11,-21.3,;17.94,-25.2,;16.4,-25.2,)| Show InChI InChI=1S/C21H30N4OS/c1-16(26)22-18-8-6-17(7-9-18)10-11-24-12-14-25(15-13-24)21-19-4-2-3-5-20(19)27-23-21/h2-5,17-18H,6-15H2,1H3,(H,22,26)/t17-,18-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.690	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from recombinant human 5-HT1A receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting metho...				Eur J Med Chem 123: 332-353 (2016) Article DOI: 10.1016/j.ejmech.2016.07.038 BindingDB Entry DOI: 10.7270/Q2GH9KXP
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50207142 (CHEMBL3973487) Show SMILES CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:4.3,wD:7.7,(11.77,-25.1,;13.32,-25.2,;14.03,-26.59,;14.08,-23.86,;15.63,-23.86,;16.4,-22.52,;17.94,-22.52,;18.71,-23.86,;20.25,-23.86,;21.02,-22.52,;22.56,-22.52,;23.33,-23.86,;24.87,-23.86,;25.64,-22.52,;24.87,-21.19,;23.33,-21.19,;27.19,-22.52,;28.11,-23.76,;29.55,-23.3,;29.55,-21.75,;30.73,-20.73,;30.37,-19.25,;28.93,-18.79,;27.8,-19.82,;28.11,-21.3,;17.94,-25.2,;16.4,-25.2,)| Show InChI InChI=1S/C21H30N4OS/c1-16(26)22-18-8-6-17(7-9-18)10-11-24-12-14-25(15-13-24)21-19-4-2-3-5-20(19)27-23-21/h2-5,17-18H,6-15H2,1H3,(H,22,26)/t17-,18-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from recombinant human 5-HT2A receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting meth...				Eur J Med Chem 123: 332-353 (2016) Article DOI: 10.1016/j.ejmech.2016.07.038 BindingDB Entry DOI: 10.7270/Q2GH9KXP
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50207142 (CHEMBL3973487) Show SMILES CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:4.3,wD:7.7,(11.77,-25.1,;13.32,-25.2,;14.03,-26.59,;14.08,-23.86,;15.63,-23.86,;16.4,-22.52,;17.94,-22.52,;18.71,-23.86,;20.25,-23.86,;21.02,-22.52,;22.56,-22.52,;23.33,-23.86,;24.87,-23.86,;25.64,-22.52,;24.87,-21.19,;23.33,-21.19,;27.19,-22.52,;28.11,-23.76,;29.55,-23.3,;29.55,-21.75,;30.73,-20.73,;30.37,-19.25,;28.93,-18.79,;27.8,-19.82,;28.11,-21.3,;17.94,-25.2,;16.4,-25.2,)| Show InChI InChI=1S/C21H30N4OS/c1-16(26)22-18-8-6-17(7-9-18)10-11-24-12-14-25(15-13-24)21-19-4-2-3-5-20(19)27-23-21/h2-5,17-18H,6-15H2,1H3,(H,22,26)/t17-,18-	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from recombinant human D2L receptor expressed in CHO cell membranes after 60 mins by scintillation counting method				Eur J Med Chem 123: 332-353 (2016) Article DOI: 10.1016/j.ejmech.2016.07.038 BindingDB Entry DOI: 10.7270/Q2GH9KXP
					More data for this Ligand-Target Pair