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SMILES: C(CN1CCN(CC1)c1nccs1)[C@H]1CC[C@@H](CC1)Nc1ncccn1

InChI Key: InChIKey=MTQWOJOFKUQLJW-QAQDUYKDSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50063297   

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
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50063297 (CHEMBL166252 | Pyrimidin-2-yl-{4-[2-(4-thiazol-2-y...) Show SMILES C(CN1CCN(CC1)c1nccs1)[C@H]1CC[C@@H](CC1)Nc1ncccn1 |wU:16.21,wD:13.14,(9.51,-6.02,;10.35,-7.3,;11.89,-7.23,;12.59,-5.86,;14.13,-5.79,;14.95,-7.07,;14.27,-8.45,;12.73,-8.52,;16.49,-6.98,;17.32,-5.7,;18.8,-6.07,;18.9,-7.61,;17.46,-8.17,;7.98,-6.09,;7.14,-4.81,;5.62,-4.88,;4.92,-6.25,;5.74,-7.54,;7.28,-7.47,;3.38,-6.3,;2.54,-5.02,;3.25,-3.67,;2.42,-2.36,;.89,-2.43,;.19,-3.81,;1.01,-5.11,)| Show InChI InChI=1S/C19H28N6S/c1-7-20-18(21-8-1)23-17-4-2-16(3-5-17)6-10-24-11-13-25(14-12-24)19-22-9-15-26-19/h1,7-9,15-17H,2-6,10-14H2,(H,20,21,23)/t16-,17-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description The binding affinity of the compound was determined by measuring its ability to displace [3H]-8-OH-DPAT radioligand in 5-hydroxytryptamine 1A recepto...				J Med Chem 41: 760-71 (1998) Article DOI: 10.1021/jm9707378 BindingDB Entry DOI: 10.7270/Q20G3J97
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50063297 (CHEMBL166252 | Pyrimidin-2-yl-{4-[2-(4-thiazol-2-y...) Show SMILES C(CN1CCN(CC1)c1nccs1)[C@H]1CC[C@@H](CC1)Nc1ncccn1 |wU:16.21,wD:13.14,(9.51,-6.02,;10.35,-7.3,;11.89,-7.23,;12.59,-5.86,;14.13,-5.79,;14.95,-7.07,;14.27,-8.45,;12.73,-8.52,;16.49,-6.98,;17.32,-5.7,;18.8,-6.07,;18.9,-7.61,;17.46,-8.17,;7.98,-6.09,;7.14,-4.81,;5.62,-4.88,;4.92,-6.25,;5.74,-7.54,;7.28,-7.47,;3.38,-6.3,;2.54,-5.02,;3.25,-3.67,;2.42,-2.36,;.89,-2.43,;.19,-3.81,;1.01,-5.11,)| Show InChI InChI=1S/C19H28N6S/c1-7-20-18(21-8-1)23-17-4-2-16(3-5-17)6-10-24-11-13-25(14-12-24)19-22-9-15-26-19/h1,7-9,15-17H,2-6,10-14H2,(H,20,21,23)/t16-,17-	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Binding affinity determined by measuring its ability to displace [3H]-N-0437 radioligand in CHO-K1 cells on Cloned Human Dopamine receptor D2				J Med Chem 41: 760-71 (1998) Article DOI: 10.1021/jm9707378 BindingDB Entry DOI: 10.7270/Q20G3J97
					More data for this Ligand-Target Pair