BDBM50417371 CHEMBL1277679

SMILES: OC(=O)C1(O)CCN(CC1)C1CCC2(C1)Cc1ccccc1Cc1ccccc21

InChI Key: InChIKey=IYAJUPFWKMPDJJ-UHFFFAOYSA-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 = 50417371   

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
Histamine H1 receptor (Homo sapiens (Human))	BDBM50417371 (CHEMBL1277679) Show SMILES OC(=O)C1(O)CCN(CC1)C1CCC2(C1)Cc1ccccc1Cc1ccccc21 Show InChI InChI=1S/C25H29NO3/c27-23(28)25(29)11-13-26(14-12-25)21-9-10-24(17-21)16-20-7-2-1-5-18(20)15-19-6-3-4-8-22(19)24/h1-8,21,29H,9-17H2,(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity against human histamine H1 receptor expressed in CHO cells by FLIPR assay				J Med Chem 53: 7778-95 (2010) Article DOI: 10.1021/jm100856p BindingDB Entry DOI: 10.7270/Q2FQ9WWQ
					More data for this Ligand-Target Pair