BDBM50072753 (S)-1-[(3S,4R)-3-(Benzo[1,3]dioxol-5-yloxymethyl)-4-(4-fluoro-phenyl)-piperidin-1-yl]-3-(1H-indol-4-yloxy)-propan-2-ol::CHEMBL113752

SMILES: O[C@H](COc1cccc2[nH]ccc12)CN1CC[C@H]([C@H](COc2ccc3OCOc3c2)C1)c1ccc(F)cc1

InChI Key: InChIKey=YGBQCFLXRKHUQM-RSEQLOHWSA-N

Data: 1 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 1 hit for monomerid = 50072753   

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))	BDBM50072753 ((S)-1-[(3S,4R)-3-(Benzo[1,3]dioxol-5-yloxymethyl)-...) Show SMILES O[C@H](COc1cccc2[nH]ccc12)CN1CC[C@H]([C@H](COc2ccc3OCOc3c2)C1)c1ccc(F)cc1 Show InChI InChI=1S/C30H31FN2O5/c31-22-6-4-20(5-7-22)25-11-13-33(15-21(25)17-35-24-8-9-29-30(14-24)38-19-37-29)16-23(34)18-36-28-3-1-2-27-26(28)10-12-32-27/h1-10,12,14,21,23,25,32,34H,11,13,15-19H2/t21-,23-,25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherche Pierre Fabre Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor				Bioorg Med Chem Lett 8: 3423-8 (1999) BindingDB Entry DOI: 10.7270/Q23J3C4J
					More data for this Ligand-Target Pair