BDBM22415 5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3.2.1]octan-2-yl]-1,3-thiazole::WIN 35,065-2 Analogue, 4s

SMILES: COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C

InChI Key: InChIKey=AUJWWBGAFLMMKB-SMTRIPRVSA-N

Data: 5 KI  1 IC50  3 EC50

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 6 hits for monomerid = 22415   

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
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM22415 (5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-...) Show SMILES COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C |TLB:30:29:17.18:21.20.15| Show InChI InChI=1S/C26H30N2O2S/c1-16-5-7-17(8-6-16)20-14-19-10-11-21(28(19)2)25(20)26-27-15-24(31-26)18-9-12-22(29-3)23(13-18)30-4/h5-9,12-13,15,19-21,25H,10-11,14H2,1-4H3/t19-,20+,21+,25-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	529	n/a	n/a	n/a	885	n/a	n/a	n/a	n/a
Research Triangle Institute					Assay Description Membranes were preincubated with drugs before the addition of [125I]RTI-55. The reaction was terminated by filtration through Wallac Filtermat A filt...				J Med Chem 50: 3686-95 (2007) Article DOI: 10.1021/jm0703035 BindingDB Entry DOI: 10.7270/Q25D8Q4T
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM22415 (5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-...) Show SMILES COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C |TLB:30:29:17.18:21.20.15| Show InChI InChI=1S/C26H30N2O2S/c1-16-5-7-17(8-6-16)20-14-19-10-11-21(28(19)2)25(20)26-27-15-24(31-26)18-9-12-22(29-3)23(13-18)30-4/h5-9,12-13,15,19-21,25H,10-11,14H2,1-4H3/t19-,20+,21+,25-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.39E+3	n/a	n/a	n/a	>6.90E+3	n/a	n/a	n/a	n/a
Research Triangle Institute					Assay Description Membranes were preincubated with drugs before the addition of [125I]RTI-55. The reaction was terminated by filtration through Wallac Filtermat A filt...				J Med Chem 50: 3686-95 (2007) Article DOI: 10.1021/jm0703035 BindingDB Entry DOI: 10.7270/Q25D8Q4T
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM22415 (5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-...) Show SMILES COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C |TLB:30:29:17.18:21.20.15| Show InChI InChI=1S/C26H30N2O2S/c1-16-5-7-17(8-6-16)20-14-19-10-11-21(28(19)2)25(20)26-27-15-24(31-26)18-9-12-22(29-3)23(13-18)30-4/h5-9,12-13,15,19-21,25H,10-11,14H2,1-4H3/t19-,20+,21+,25-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute					Assay Description Brains from male Sprague-Dawley rats were removed, dissected, and rapidly frozen. Ligand binding experiments were conducted in assay tubes containing...				J Med Chem 50: 3686-95 (2007) Article DOI: 10.1021/jm0703035 BindingDB Entry DOI: 10.7270/Q25D8Q4T
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus (rat))	BDBM22415 (5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-...) Show SMILES COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C |TLB:30:29:17.18:21.20.15| Show InChI InChI=1S/C26H30N2O2S/c1-16-5-7-17(8-6-16)20-14-19-10-11-21(28(19)2)25(20)26-27-15-24(31-26)18-9-12-22(29-3)23(13-18)30-4/h5-9,12-13,15,19-21,25H,10-11,14H2,1-4H3/t19-,20+,21+,25-/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute					Assay Description Brains from male Sprague-Dawley rats were removed, dissected, and rapidly frozen. Ligand binding experiments were conducted in assay tubes containing...				J Med Chem 50: 3686-95 (2007) Article DOI: 10.1021/jm0703035 BindingDB Entry DOI: 10.7270/Q25D8Q4T
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM22415 (5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-...) Show SMILES COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C |TLB:30:29:17.18:21.20.15| Show InChI InChI=1S/C26H30N2O2S/c1-16-5-7-17(8-6-16)20-14-19-10-11-21(28(19)2)25(20)26-27-15-24(31-26)18-9-12-22(29-3)23(13-18)30-4/h5-9,12-13,15,19-21,25H,10-11,14H2,1-4H3/t19-,20+,21+,25-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	7.71E+3	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Research Triangle Institute					Assay Description Membranes were preincubated with drugs before the addition of [125I]RTI-55. The reaction was terminated by filtration through Wallac Filtermat A filt...				J Med Chem 50: 3686-95 (2007) Article DOI: 10.1021/jm0703035 BindingDB Entry DOI: 10.7270/Q25D8Q4T
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM22415 (5-(3,4-dimethoxyphenyl)-2-[(1R,2S,3S,5S)-8-methyl-...) Show SMILES COc1ccc(cc1OC)-c1cnc(s1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)N2C |TLB:30:29:17.18:21.20.15| Show InChI InChI=1S/C26H30N2O2S/c1-16-5-7-17(8-6-16)20-14-19-10-11-21(28(19)2)25(20)26-27-15-24(31-26)18-9-12-22(29-3)23(13-18)30-4/h5-9,12-13,15,19-21,25H,10-11,14H2,1-4H3/t19-,20+,21+,25-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	7.4	4
Research Triangle Institute					Assay Description Brains from male Sprague-Dawley rats were removed, dissected, and rapidly frozen. Ligand binding experiments were conducted in assay tubes containing...				J Med Chem 50: 3686-95 (2007) Article DOI: 10.1021/jm0703035 BindingDB Entry DOI: 10.7270/Q25D8Q4T
					More data for this Ligand-Target Pair