BDBM50053899 Allyl-(9-allyl-2-{4-[(10,10-dioxo-11-propyl-10,11-dihydro-5H-10lambda*6*-thia-11-aza-dibenzo[a,d]cyclohepten-5-ylmethyl)-amino]-piperidin-1-yl}-9H-purin-6-yl)-amine::CHEMBL337682

SMILES: CCCN1c2ccccc2C(CNC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccccc2S1(=O)=O

InChI Key: InChIKey=VTYUMKPNIZXZRB-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 = 50053899   

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)	BDBM50053899 (Allyl-(9-allyl-2-{4-[(10,10-dioxo-11-propyl-10,11-...) Show SMILES CCCN1c2ccccc2C(CNC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccccc2S1(=O)=O Show InChI InChI=1S/C33H40N8O2S/c1-4-17-34-31-30-32(40(18-5-2)23-36-30)38-33(37-31)39-20-15-24(16-21-39)35-22-27-25-11-7-9-13-28(25)41(19-6-3)44(42,43)29-14-10-8-12-26(27)29/h4-5,7-14,23-24,27,35H,1-2,6,15-22H2,3H3,(H,34,37,38)	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	490	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
					More data for this Ligand-Target Pair