Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' and Ligand = 'BDBM50336086'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histamine H1 receptor (Homo sapiens (Human))	BDBM50336086 ((R)-N-methyl-2-(3-(1-(pyrazin-2-yl)ethyl)-1H-inden...) Show SMILES C[C@H](C1=C(CCN(C)Cc2ccncc2)Cc2ccccc12)c1cnccn1 |r,c:2| Show InChI InChI=1S/C24H26N4/c1-18(23-16-26-12-13-27-23)24-21(15-20-5-3-4-6-22(20)24)9-14-28(2)17-19-7-10-25-11-8-19/h3-8,10-13,16,18H,9,14-15,17H2,1-2H3/t18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Curated by ChEMBL					Assay Description Binding affinity to histamine H1 receptor				Bioorg Med Chem Lett 21: 947-51 (2011) Article DOI: 10.1016/j.bmcl.2010.12.053 BindingDB Entry DOI: 10.7270/Q2319W59
					More data for this Ligand-Target Pair