BDBM50134680 CHEMBL3747148

SMILES: CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cccc(F)c1

InChI Key: InChIKey=BLDRZOKSSGFKEP-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50134680   

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))	BDBM50134680 (CHEMBL3747148) Show SMILES CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cccc(F)c1 Show InChI InChI=1S/C26H35FN2O3S/c1-20(2)25-8-3-4-9-26(25)32-17-16-28-14-12-23(13-15-28)29(19-21-10-11-21)33(30,31)24-7-5-6-22(27)18-24/h3-9,18,20-21,23H,10-17,19H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	15	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 cells incubated for 1 hr				Bioorg Med Chem 24: 130-9 (2016) BindingDB Entry DOI: 10.7270/Q2W95C1P
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50134680 (CHEMBL3747148) Show SMILES CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cccc(F)c1 Show InChI InChI=1S/C26H35FN2O3S/c1-20(2)25-8-3-4-9-26(25)32-17-16-28-14-12-23(13-15-28)29(19-21-10-11-21)33(30,31)24-7-5-6-22(27)18-24/h3-9,18,20-21,23H,10-17,19H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	56	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 5-HT7B receptor expressed in HEK293 cells incubated for 1 hr				Bioorg Med Chem 24: 130-9 (2016) BindingDB Entry DOI: 10.7270/Q2W95C1P
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50134680 (CHEMBL3747148) Show SMILES CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cccc(F)c1 Show InChI InChI=1S/C26H35FN2O3S/c1-20(2)25-8-3-4-9-26(25)32-17-16-28-14-12-23(13-15-28)29(19-21-10-11-21)33(30,31)24-7-5-6-22(27)18-24/h3-9,18,20-21,23H,10-17,19H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	158	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 5-HT1A receptor expressed in HEK293 cells incubated for 1 hr				Bioorg Med Chem 24: 130-9 (2016) BindingDB Entry DOI: 10.7270/Q2W95C1P
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50134680 (CHEMBL3747148) Show SMILES CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cccc(F)c1 Show InChI InChI=1S/C26H35FN2O3S/c1-20(2)25-8-3-4-9-26(25)32-17-16-28-14-12-23(13-15-28)29(19-21-10-11-21)33(30,31)24-7-5-6-22(27)18-24/h3-9,18,20-21,23H,10-17,19H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	429	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 5-HT2A receptor expressed in HEK293 cells incubated for 1 hr				Bioorg Med Chem 24: 130-9 (2016) BindingDB Entry DOI: 10.7270/Q2W95C1P
					More data for this Ligand-Target Pair