BDBM10236 5-chloro-2-cyclopropyl-13-{[(2,6-dimethylpyridin-4-yl)sulfanyl]methyl}-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one::8-heteroarylthiomethyldipyridodiazepinone deriv. 18

SMILES: Cc1cc(SCc2cnc3N(C4CC4)c4nc(Cl)cc(C)c4NC(=O)c3c2)cc(C)n1

InChI Key: InChIKey=SNKPYTPMXOONSA-UHFFFAOYSA-N

Data: 2 IC50

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 = 10236   

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
HIV-1 Reverse Transcriptase Mutant (K103N/Y181C) (Human immunodeficiency virus type 1)	BDBM10236 (5-chloro-2-cyclopropyl-13-{[(2,6-dimethylpyridin-4...) Show SMILES Cc1cc(SCc2cnc3N(C4CC4)c4nc(Cl)cc(C)c4NC(=O)c3c2)cc(C)n1 Show InChI InChI=1S/C23H22ClN5OS/c1-12-6-19(24)27-22-20(12)28-23(30)18-9-15(10-25-21(18)29(22)16-4-5-16)11-31-17-7-13(2)26-14(3)8-17/h6-10,16H,4-5,11H2,1-3H3,(H,28,30)	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	7.4	37
Boehringer Ingelheim (Canada) Ltd.					Assay Description IC50 values for wild-type and mutant RTs were obtained from a scintillation proximity assay using poly rC/biotin-dG15 and 3H-dGTP. Each value represe...				Bioorg Med Chem Lett 14: 739-42 (2004) Article DOI: 10.1016/j.bmcl.2003.11.049 BindingDB Entry DOI: 10.7270/Q2C53J2D
					More data for this Ligand-Target Pair
HIV-1 Reverse Transcriptase (Human immunodeficiency virus type 1)	BDBM10236 (5-chloro-2-cyclopropyl-13-{[(2,6-dimethylpyridin-4...) Show SMILES Cc1cc(SCc2cnc3N(C4CC4)c4nc(Cl)cc(C)c4NC(=O)c3c2)cc(C)n1 Show InChI InChI=1S/C23H22ClN5OS/c1-12-6-19(24)27-22-20(12)28-23(30)18-9-15(10-25-21(18)29(22)16-4-5-16)11-31-17-7-13(2)26-14(3)8-17/h6-10,16H,4-5,11H2,1-3H3,(H,28,30)	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	7.4	37
Boehringer Ingelheim (Canada) Ltd.					Assay Description IC50 values for wild-type and mutant RTs were obtained from a scintillation proximity assay using poly rC/biotin-dG15 and 3H-dGTP. Each value represe...				Bioorg Med Chem Lett 14: 739-42 (2004) Article DOI: 10.1016/j.bmcl.2003.11.049 BindingDB Entry DOI: 10.7270/Q2C53J2D
					More data for this Ligand-Target Pair