BDBM50253471 CHEMBL494510::Naphthalene-2-carboxylic acid {4-[2-((S)-2-amino-4,5,6,7-tetrahydro-benzothiazol-6-ylamino)-ethyl]-cyclohexyl}-amide

SMILES: Nc1nc2CC[C@@H](Cc2s1)NCC[C@H]1CC[C@@H](CC1)NC(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=NAJAFAGBGXSZLZ-HSQYWUDLSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50253471   

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 (Rattus norvegicus (Rat))	BDBM50253471 (CHEMBL494510 | Naphthalene-2-carboxylic acid {4-[2...) Show SMILES Nc1nc2CC[C@@H](Cc2s1)NCC[C@H]1CC[C@@H](CC1)NC(=O)c1ccc2ccccc2c1 |r,wU:13.14,wD:6.11,16.21,(-11.26,-.53,;-9.72,-.53,;-8.8,.73,;-7.32,.25,;-5.99,1.02,;-4.65,.24,;-4.65,-1.31,;-5.99,-2.08,;-7.32,-1.31,;-8.8,-1.79,;-3.32,-2.08,;-1.98,-1.31,;-.65,-2.08,;.69,-1.32,;.68,.22,;2.02,.99,;3.35,.21,;3.34,-1.33,;2.01,-2.09,;4.69,.98,;6.02,.21,;6.02,-1.33,;7.35,.98,;8.68,.2,;10.02,.97,;10.01,2.51,;11.34,3.28,;11.35,4.82,;10,5.59,;8.68,4.82,;8.68,3.28,;7.35,2.51,)| Show InChI InChI=1S/C26H32N4OS/c27-26-30-23-12-11-22(16-24(23)32-26)28-14-13-17-5-9-21(10-6-17)29-25(31)20-8-7-18-3-1-2-4-19(18)15-20/h1-4,7-8,15,17,21-22,28H,5-6,9-14,16H2,(H2,27,30)(H,29,31)/t17-,21-,22-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]PD128907 from dopamine D3 receptor in Sprague-Dawley rat ventral striatum				J Med Chem 51: 5905-8 (2008) Article DOI: 10.1021/jm800471h BindingDB Entry DOI: 10.7270/Q2FN161H
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50253471 (CHEMBL494510 | Naphthalene-2-carboxylic acid {4-[2...) Show SMILES Nc1nc2CC[C@@H](Cc2s1)NCC[C@H]1CC[C@@H](CC1)NC(=O)c1ccc2ccccc2c1 |r,wU:13.14,wD:6.11,16.21,(-11.26,-.53,;-9.72,-.53,;-8.8,.73,;-7.32,.25,;-5.99,1.02,;-4.65,.24,;-4.65,-1.31,;-5.99,-2.08,;-7.32,-1.31,;-8.8,-1.79,;-3.32,-2.08,;-1.98,-1.31,;-.65,-2.08,;.69,-1.32,;.68,.22,;2.02,.99,;3.35,.21,;3.34,-1.33,;2.01,-2.09,;4.69,.98,;6.02,.21,;6.02,-1.33,;7.35,.98,;8.68,.2,;10.02,.97,;10.01,2.51,;11.34,3.28,;11.35,4.82,;10,5.59,;8.68,4.82,;8.68,3.28,;7.35,2.51,)| Show InChI InChI=1S/C26H32N4OS/c27-26-30-23-12-11-22(16-24(23)32-26)28-14-13-17-5-9-21(10-6-17)29-25(31)20-8-7-18-3-1-2-4-19(18)15-20/h1-4,7-8,15,17,21-22,28H,5-6,9-14,16H2,(H2,27,30)(H,29,31)/t17-,21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	670	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]Spiperone from D2 receptor in Sprague-Dawley rat caudate-putamen				J Med Chem 51: 5905-8 (2008) Article DOI: 10.1021/jm800471h BindingDB Entry DOI: 10.7270/Q2FN161H
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50253471 (CHEMBL494510 | Naphthalene-2-carboxylic acid {4-[2...) Show SMILES Nc1nc2CC[C@@H](Cc2s1)NCC[C@H]1CC[C@@H](CC1)NC(=O)c1ccc2ccccc2c1 |r,wU:13.14,wD:6.11,16.21,(-11.26,-.53,;-9.72,-.53,;-8.8,.73,;-7.32,.25,;-5.99,1.02,;-4.65,.24,;-4.65,-1.31,;-5.99,-2.08,;-7.32,-1.31,;-8.8,-1.79,;-3.32,-2.08,;-1.98,-1.31,;-.65,-2.08,;.69,-1.32,;.68,.22,;2.02,.99,;3.35,.21,;3.34,-1.33,;2.01,-2.09,;4.69,.98,;6.02,.21,;6.02,-1.33,;7.35,.98,;8.68,.2,;10.02,.97,;10.01,2.51,;11.34,3.28,;11.35,4.82,;10,5.59,;8.68,4.82,;8.68,3.28,;7.35,2.51,)| Show InChI InChI=1S/C26H32N4OS/c27-26-30-23-12-11-22(16-24(23)32-26)28-14-13-17-5-9-21(10-6-17)29-25(31)20-8-7-18-3-1-2-4-19(18)15-20/h1-4,7-8,15,17,21-22,28H,5-6,9-14,16H2,(H2,27,30)(H,29,31)/t17-,21-,22-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]SCH23390 from D1-like receptor in Sprague-Dawley rat striatum				J Med Chem 51: 5905-8 (2008) Article DOI: 10.1021/jm800471h BindingDB Entry DOI: 10.7270/Q2FN161H
					More data for this Ligand-Target Pair