BDBM99895 US8501767, 81

SMILES: Fc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccccc1Cl

InChI Key: InChIKey=DLKJOGSCPKQKTQ-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 = 99895   

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)	BDBM99895 (US8501767, 81) Show SMILES Fc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccccc1Cl Show InChI InChI=1S/C19H19ClFN3/c20-16-9-5-4-8-15(16)18-19(22-14-6-2-1-3-7-14)24-12-13(21)10-11-17(24)23-18/h4-5,8-12,14,22H,1-3,6-7H2	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.13E+4	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)	BDBM99895 (US8501767, 81) Show SMILES Fc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccccc1Cl Show InChI InChI=1S/C19H19ClFN3/c20-16-9-5-4-8-15(16)18-19(22-14-6-2-1-3-7-14)24-12-13(21)10-11-17(24)23-18/h4-5,8-12,14,22H,1-3,6-7H2	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.13E+4	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