BDBM50425437 CHEMBL2312935

SMILES: Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl

InChI Key: InChIKey=UZRQUYOHSFAJFG-UHFFFAOYSA-N

Data: 6 KI  1 IC50  1 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 8 hits for monomerid = 50425437   

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(2) dopamine receptor (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-raclopride from human dopamine D2L receptor expressed in HEK293 after 1 hr				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in HEK293 after 1 hr				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-5-CT from human 5HT7 receptor expressed in HEK293 after 1 hr				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-ketanserin from human 5HT2A receptor expressed in HEK293 after 1.5 hrs				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from SERT in rat cerebral cortex after 1 hr by scintillation counting				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 after 1 hr				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Antagonist activity at human 5HT7 receptor expressed in HEK293 assessed as inhibition of 5HT-induced cAMP accumulation				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50425437 (CHEMBL2312935) Show SMILES Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2S/c24-20-7-5-9-22(23(20)25)29-14-12-28(13-15-29)11-4-3-10-27-32(30,31)19-16-18-6-1-2-8-21(18)26-17-19/h1-2,5-9,16-17,27H,3-4,10-15H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.65E+3	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Agonist activity at human 5HT1A receptor expressed in CHO cells assessed as cAMP accumulation				Eur J Med Chem 60: 42-50 (2013) Article DOI: 10.1016/j.ejmech.2012.11.042 BindingDB Entry DOI: 10.7270/Q21V5G98
					More data for this Ligand-Target Pair