BDBM50482842 CHEMBL1257316

SMILES: Cc1cc(cc(C)c1Oc1ccnc(NC2CCN(CC2)c2ccc(Cl)c(c2)C(N)=O)n1)C#N

InChI Key: InChIKey=UXRFRQBRUGBAOV-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 = 50482842   

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)	BDBM50482842 (CHEMBL1257316) Show SMILES Cc1cc(cc(C)c1Oc1ccnc(NC2CCN(CC2)c2ccc(Cl)c(c2)C(N)=O)n1)C#N Show InChI InChI=1S/C25H25ClN6O2/c1-15-11-17(14-27)12-16(2)23(15)34-22-5-8-29-25(31-22)30-18-6-9-32(10-7-18)19-3-4-21(26)20(13-19)24(28)33/h3-5,8,11-13,18H,6-7,9-10H2,1-2H3,(H2,28,33)(H,29,30,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Roche R&D Center China Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant wild type reverse transcriptase by SPA heteropolymeric assay				Bioorg Med Chem Lett 20: 6020-3 (2010) Article DOI: 10.1016/j.bmcl.2010.08.068 BindingDB Entry DOI: 10.7270/Q2T72M88
					More data for this Ligand-Target Pair
Reverse Transcriptase (Human immunodeficiency virus 1)	BDBM50482842 (CHEMBL1257316) Show SMILES Cc1cc(cc(C)c1Oc1ccnc(NC2CCN(CC2)c2ccc(Cl)c(c2)C(N)=O)n1)C#N Show InChI InChI=1S/C25H25ClN6O2/c1-15-11-17(14-27)12-16(2)23(15)34-22-5-8-29-25(31-22)30-18-6-9-32(10-7-18)19-3-4-21(26)20(13-19)24(28)33/h3-5,8,11-13,18H,6-7,9-10H2,1-2H3,(H2,28,33)(H,29,30,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	192	n/a	n/a	n/a	n/a	n/a	n/a
Roche R&D Center China Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase K103N/Y181C double mutant by SPA heteropolymeric assay				Bioorg Med Chem Lett 20: 6020-3 (2010) Article DOI: 10.1016/j.bmcl.2010.08.068 BindingDB Entry DOI: 10.7270/Q2T72M88
					More data for this Ligand-Target Pair