BDBM50053890 (1-Allyl-6-{4-[(2-methoxy-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylmethyl)-amino]-piperidin-1-yl}-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-propyl-amine::CHEMBL130301

SMILES: CCCNc1nc(nc2n(CC=C)ncc12)N1CCC(CC1)NCC1c2ccccc2CCc2cc(OC)ccc12

InChI Key: InChIKey=JFSIOZQPRKDSPE-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 = 50053890   

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
Voltage-gated L-type calcium channel (Rattus norvegicus)	BDBM50053890 ((1-Allyl-6-{4-[(2-methoxy-10,11-dihydro-5H-dibenzo...) Show SMILES CCCNc1nc(nc2n(CC=C)ncc12)N1CCC(CC1)NCC1c2ccccc2CCc2cc(OC)ccc12 Show InChI InChI=1S/C33H41N7O/c1-4-16-34-31-30-22-36-40(17-5-2)32(30)38-33(37-31)39-18-14-25(15-19-39)35-21-29-27-9-7-6-8-23(27)10-11-24-20-26(41-3)12-13-28(24)29/h5-9,12-13,20,22,25,29,35H,2,4,10-11,14-19,21H2,1,3H3,(H,34,37,38)	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
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