BDBM50138405 CHEMBL341421::[(2R,5S)-5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl]methyl tetrahydrogen triphosphate

SMILES: Nc1nc(=O)n(cc1F)[C@@H]1CS[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O1

InChI Key: InChIKey=WIEOLFZNMKSGEX-NTSWFWBYSA-N

Data: 1 Kd

PDB links: 8 PDB IDs match this monomer.

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 = 50138405   

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
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50138405 (CHEMBL341421 | [(2R,5S)-5-(4-amino-5-fluoro-2-oxop...) Show SMILES Nc1nc(=O)n(cc1F)[C@@H]1CS[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O1 Show InChI InChI=1S/C8H13FN3O12P3S/c9-4-1-12(8(13)11-7(4)10)5-3-28-6(22-5)2-21-26(17,18)24-27(19,20)23-25(14,15)16/h1,5-6H,2-3H2,(H,17,18)(H,19,20)(H2,10,11,13)(H2,14,15,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid PDB UniChem Similars	PDB PubMed	n/a	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a
The University of Georgia Curated by ChEMBL					Assay Description Equilibrium binding constant at the active site of HIV-1 reverse transcriptase				Bioorg Med Chem Lett 14: 437-40 (2003) BindingDB Entry DOI: 10.7270/Q2RX9BGK
					More data for this Ligand-Target Pair				3D Structure (crystal)