null

SMILES: CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2Cl)ccc2c(C)cc(=O)oc12

InChI Key: InChIKey=MLBJSKCPQRFALF-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50454160   

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
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50454160 (CHEMBL4209403) Show SMILES CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2Cl)ccc2c(C)cc(=O)oc12 Show InChI InChI=1S/C25H27ClN2O4/c1-17-16-23(30)32-25-19(17)8-9-22(24(25)18(2)29)31-15-5-10-27-11-13-28(14-12-27)21-7-4-3-6-20(21)26/h3-4,6-9,16H,5,10-15H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHO-K1 cell membranes after 60 mins by microbeta scintillation counting analys...				Bioorg Med Chem 26: 527-535 (2018) Article DOI: 10.1016/j.bmc.2017.12.016 BindingDB Entry DOI: 10.7270/Q2DF6TTS
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50454160 (CHEMBL4209403) Show SMILES CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2Cl)ccc2c(C)cc(=O)oc12 Show InChI InChI=1S/C25H27ClN2O4/c1-17-16-23(30)32-25-19(17)8-9-22(24(25)18(2)29)31-15-5-10-27-11-13-28(14-12-27)21-7-4-3-6-20(21)26/h3-4,6-9,16H,5,10-15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]-ketanserin from human 5-HT2A receptor expressed in CHO-K1 cell membranes after 60 mins by microbeta scintillation counting analy...				Bioorg Med Chem 26: 527-535 (2018) Article DOI: 10.1016/j.bmc.2017.12.016 BindingDB Entry DOI: 10.7270/Q2DF6TTS
					More data for this Ligand-Target Pair