BDBM50134782 6-amino-9-[(Z)-(2-{[(1,2,3,3-tetrahydroxy-1,2,3-trioxidotriphosphanyl)oxy]methyl}cyclopropylidene)methyl]-9H-purine::CHEMBL145297

SMILES: Nc1ncnc2n(\C=C3\CC3COP(O)(=O)P(O)(=O)P(O)(O)=O)cnc12

InChI Key: InChIKey=LKLMGCFUHMAWCU-KXFIGUGUSA-N

Data: 3 KI

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 3 hits for monomerid = 50134782   

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/RNaseH (Human immunodeficiency virus 1)	BDBM50134782 (6-amino-9-[(Z)-(2-{[(1,2,3,3-tetrahydroxy-1,2,3-tr...) Show SMILES Nc1ncnc2n(\C=C3\CC3COP(O)(=O)P(O)(=O)P(O)(O)=O)cnc12 Show InChI InChI=1S/C10H14N5O8P3/c11-9-8-10(13-4-12-9)15(5-14-8)2-6-1-7(6)3-23-25(19,20)26(21,22)24(16,17)18/h2,4-5,7H,1,3H2,(H,19,20)(H,21,22)(H2,11,12,13)(H2,16,17,18)/b6-2-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	320	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University School of Medicine Curated by ChEMBL					Assay Description Inhibitory activity against HIV-1 Reverse transcriptase wild-type (RT wt)				J Med Chem 46: 4799-802 (2003) Article DOI: 10.1021/jm030048y BindingDB Entry DOI: 10.7270/Q2D50NQB
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50134782 (6-amino-9-[(Z)-(2-{[(1,2,3,3-tetrahydroxy-1,2,3-tr...) Show SMILES Nc1ncnc2n(\C=C3\CC3COP(O)(=O)P(O)(=O)P(O)(O)=O)cnc12 Show InChI InChI=1S/C10H14N5O8P3/c11-9-8-10(13-4-12-9)15(5-14-8)2-6-1-7(6)3-23-25(19,20)26(21,22)24(16,17)18/h2,4-5,7H,1,3H2,(H,19,20)(H,21,22)(H2,11,12,13)(H2,16,17,18)/b6-2-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University School of Medicine Curated by ChEMBL					Assay Description Inhibitory activity against HIV-1 reverse transcriptase (RT M184V)				J Med Chem 46: 4799-802 (2003) Article DOI: 10.1021/jm030048y BindingDB Entry DOI: 10.7270/Q2D50NQB
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50134782 (6-amino-9-[(Z)-(2-{[(1,2,3,3-tetrahydroxy-1,2,3-tr...) Show SMILES Nc1ncnc2n(\C=C3\CC3COP(O)(=O)P(O)(=O)P(O)(O)=O)cnc12 Show InChI InChI=1S/C10H14N5O8P3/c11-9-8-10(13-4-12-9)15(5-14-8)2-6-1-7(6)3-23-25(19,20)26(21,22)24(16,17)18/h2,4-5,7H,1,3H2,(H,19,20)(H,21,22)(H2,11,12,13)(H2,16,17,18)/b6-2-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University School of Medicine Curated by ChEMBL					Assay Description Inhibitory activity against HIV-1 reverse transcriptase (RT M184I)				J Med Chem 46: 4799-802 (2003) Article DOI: 10.1021/jm030048y BindingDB Entry DOI: 10.7270/Q2D50NQB
					More data for this Ligand-Target Pair