BDBM50087957 CHEMBL3426953

SMILES: Cc1cc(cc(C)c1Oc1ccnc(NC2CCN(CC(=O)Nc3ccccc3)CC2)n1)C#N

InChI Key: InChIKey=DBGRICQASJFZGF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50087957   

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)	BDBM50087957 (CHEMBL3426953) Show SMILES Cc1cc(cc(C)c1Oc1ccnc(NC2CCN(CC(=O)Nc3ccccc3)CC2)n1)C#N Show InChI InChI=1S/C26H28N6O2/c1-18-14-20(16-27)15-19(2)25(18)34-24-8-11-28-26(31-24)30-22-9-12-32(13-10-22)17-23(33)29-21-6-4-3-5-7-21/h3-8,11,14-15,22H,9-10,12-13,17H2,1-2H3,(H,29,33)(H,28,30,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	199	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant wild type reverse transcriptase p66/p51 assessed as reduction in biotin-labeled dUTP incorporation into DNA using poly...				Eur J Med Chem 97: 1-9 (2015) Article DOI: 10.1016/j.ejmech.2015.04.050 BindingDB Entry DOI: 10.7270/Q22Z178R
					More data for this Ligand-Target Pair