BDBM2184 SM30::US8501787, 166

SMILES: Cc1cccc2nc(c(NC3CCCCC3)n12)-c1ccccc1Cl

InChI Key: InChIKey=FKSAWGDCELGVTE-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 = 2184   

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
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2184 (SM30 | US8501787, 166) Show SMILES Cc1cccc2nc(c(NC3CCCCC3)n12)-c1ccccc1Cl Show InChI InChI=1S/C20H22ClN3/c1-14-8-7-13-18-23-19(16-11-5-6-12-17(16)21)20(24(14)18)22-15-9-3-2-4-10-15/h5-8,11-13,15,22H,2-4,9-10H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR Biosciences Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as residual enzyme activity at 50 uM after 1 hr by ELISA				Bioorg Med Chem 19: 4227-37 (2011) Article DOI: 10.1016/j.bmc.2011.05.062 BindingDB Entry DOI: 10.7270/Q29K4F22
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM2184 (SM30 | US8501787, 166) Show SMILES Cc1cccc2nc(c(NC3CCCCC3)n12)-c1ccccc1Cl Show InChI InChI=1S/C20H22ClN3/c1-14-8-7-13-18-23-19(16-11-5-6-12-17(16)21)20(24(14)18)22-15-9-3-2-4-10-15/h5-8,11-13,15,22H,2-4,9-10H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR US Patent					Assay Description The assay is based on a sandwich-ELISA protocol employing the ROCHE colorimetric reverse transcriptase kit (cat # 1468120910).				US Patent US8501767 (2013) BindingDB Entry DOI: 10.7270/Q2Z60MPS
					More data for this Ligand-Target Pair