BDBM50046717 CHEMBL2018791

SMILES: [H][C@@]12Sc3ccccc3C(=O)N1C[C@@H](O)[C@H](O)[C@@H]2O

InChI Key: InChIKey=QSTIQBJVDMSSEK-NKIYYHGXSA-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 = 50046717   

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)	BDBM50046717 (CHEMBL2018791) Show SMILES [H][C@@]12Sc3ccccc3C(=O)N1C[C@@H](O)[C@H](O)[C@@H]2O |r| Show InChI InChI=1S/C12H13NO4S/c14-7-5-13-11(17)6-3-1-2-4-8(6)18-12(13)10(16)9(7)15/h1-4,7,9-10,12,14-16H,5H2/t7-,9+,10+,12+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hebei University Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase after 1 hr by ELISA plate reader analysis				Bioorg Med Chem Lett 24: 3426-9 (2014) Article DOI: 10.1016/j.bmcl.2014.05.079 BindingDB Entry DOI: 10.7270/Q25H7HWV
					More data for this Ligand-Target Pair