BDBM50053882 CHEMBL340348::[1-(9-Allyl-6-allylamino-9H-purin-2-yl)-piperidin-4-yl]-(8-chloro-11-methyl-10,10-dioxo-10,11-dihydro-5H-10lambda*6*-thia-11-aza-dibenzo[a,d]cyclohepten-5-yl)-amine

SMILES: CN1c2ccccc2C(NC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccc(Cl)cc2S1(=O)=O

InChI Key: InChIKey=YVTAHDZTVZAOLD-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50053882   

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)	BDBM50053882 (CHEMBL340348 | [1-(9-Allyl-6-allylamino-9H-purin-2...) Show SMILES CN1c2ccccc2C(NC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccc(Cl)cc2S1(=O)=O Show InChI InChI=1S/C30H33ClN8O2S/c1-4-14-32-28-27-29(39(15-5-2)19-33-27)36-30(35-28)38-16-12-21(13-17-38)34-26-22-8-6-7-9-24(22)37(3)42(40,41)25-18-20(31)10-11-23(25)26/h4-11,18-19,21,26,34H,1-2,12-17H2,3H3,(H,32,35,36)	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	650	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
Voltage-gated L-type calcium channel (Rattus norvegicus)	BDBM50053882 (CHEMBL340348 | [1-(9-Allyl-6-allylamino-9H-purin-2...) Show SMILES CN1c2ccccc2C(NC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccc(Cl)cc2S1(=O)=O Show InChI InChI=1S/C30H33ClN8O2S/c1-4-14-32-28-27-29(39(15-5-2)19-33-27)36-30(35-28)38-16-12-21(13-17-38)34-26-22-8-6-7-9-24(22)37(3)42(40,41)25-18-20(31)10-11-23(25)26/h4-11,18-19,21,26,34H,1-2,12-17H2,3H3,(H,32,35,36)	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	650	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