BDBM50052849 CHEMBL119900::Trifluoro-methanesulfonic acid (R)-11-methoxy-6-propyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-yl ester

SMILES: CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(OS(=O)(=O)C(F)(F)F)c(OC)c-31

InChI Key: InChIKey=VFZQJEHONJLING-MRXNPFEDSA-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 = 50052849   

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))	BDBM50052849 (CHEMBL119900 | Trifluoro-methanesulfonic acid (R)-...) Show SMILES CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(OS(=O)(=O)C(F)(F)F)c(OC)c-31 Show InChI InChI=1S/C21H22F3NO4S/c1-3-10-25-11-9-13-5-4-6-15-18(13)16(25)12-14-7-8-17(20(28-2)19(14)15)29-30(26,27)21(22,23)24/h4-8,16H,3,9-12H2,1-2H3/t16-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	403	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description In vitro affinity at human cloned Dopamine receptor D2A by [3H]-raclopride displacement.				J Med Chem 39: 3491-502 (1996) Article DOI: 10.1021/jm960188q BindingDB Entry DOI: 10.7270/Q2XW4HXS
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50052849 (CHEMBL119900 | Trifluoro-methanesulfonic acid (R)-...) Show SMILES CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(OS(=O)(=O)C(F)(F)F)c(OC)c-31 Show InChI InChI=1S/C21H22F3NO4S/c1-3-10-25-11-9-13-5-4-6-15-18(13)16(25)12-14-7-8-17(20(28-2)19(14)15)29-30(26,27)21(22,23)24/h4-8,16H,3,9-12H2,1-2H3/t16-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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
Uppsala University Curated by ChEMBL					Assay Description In vitro affinity at Dopamine receptor D1 of rat striatum by [3H]-SCH-23,390 displacement.				J Med Chem 39: 3491-502 (1996) Article DOI: 10.1021/jm960188q BindingDB Entry DOI: 10.7270/Q2XW4HXS
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50052849 (CHEMBL119900 | Trifluoro-methanesulfonic acid (R)-...) Show SMILES CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(OS(=O)(=O)C(F)(F)F)c(OC)c-31 Show InChI InChI=1S/C21H22F3NO4S/c1-3-10-25-11-9-13-5-4-6-15-18(13)16(25)12-14-7-8-17(20(28-2)19(14)15)29-30(26,27)21(22,23)24/h4-8,16H,3,9-12H2,1-2H3/t16-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description In vitro affinity at 5-hydroxytryptamine 1A receptor of rat hippocampus by [3H]-8-OH-DPAT displacement.				J Med Chem 39: 3491-502 (1996) Article DOI: 10.1021/jm960188q BindingDB Entry DOI: 10.7270/Q2XW4HXS
					More data for this Ligand-Target Pair