BDBM50369390 CHEMBL54224

SMILES: Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1

InChI Key: InChIKey=HDRRAMINWIWTNU-NTSWFWBYSA-N

Data: 7 IC50

PDB links: 17 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 7 hits for monomerid = 50369390   

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
Telomerase reverse transcriptase (Homo sapiens (Human))	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Concentration required to inhibit telomerase activity				J Med Chem 41: 3253-60 (1998) Article DOI: 10.1021/jm9801105 BindingDB Entry DOI: 10.7270/Q2TX3G1R
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Alcal£ Curated by ChEMBL					Assay Description Inhibitory activity against R172A mutant reverse transcriptase				J Med Chem 44: 1853-65 (2001) Article DOI: 10.1021/jm001095i BindingDB Entry DOI: 10.7270/Q20V8GJ7
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	855	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Alcal£ Curated by ChEMBL					Assay Description Inhibitory activity against wild-type HIV-1 reverse transcriptase				J Med Chem 44: 1853-65 (2001) Article DOI: 10.1021/jm001095i BindingDB Entry DOI: 10.7270/Q20V8GJ7
					More data for this Ligand-Target Pair
Reverse Transcriptase (Human immunodeficiency virus 1)	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	244	n/a	n/a	n/a	n/a	n/a	n/a
Rutgers University Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase K101E mutant-mediated polymerization reaction after 30 mins				J Med Chem 54: 2727-37 (2011) Article DOI: 10.1021/jm101536x BindingDB Entry DOI: 10.7270/Q2PZ5CPW
					More data for this Ligand-Target Pair
Reverse Transcriptase (Human immunodeficiency virus 1)	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	223	n/a	n/a	n/a	n/a	n/a	n/a
Rutgers University Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase E138K mutant-mediated polymerization reaction after 30 mins				J Med Chem 54: 2727-37 (2011) Article DOI: 10.1021/jm101536x BindingDB Entry DOI: 10.7270/Q2PZ5CPW
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	223	n/a	n/a	n/a	n/a	n/a	n/a
Rutgers University Curated by ChEMBL					Assay Description Inhibition of wild type HIV-1 reverse transcriptase-mediated polymerization reaction after 30 mins				J Med Chem 54: 2727-37 (2011) Article DOI: 10.1021/jm101536x BindingDB Entry DOI: 10.7270/Q2PZ5CPW
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50369390 (CHEMBL54224) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	875	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Alcal£ Curated by ChEMBL					Assay Description Inhibitory activity against E138K mutant reverse transcriptase				J Med Chem 44: 1853-65 (2001) Article DOI: 10.1021/jm001095i BindingDB Entry DOI: 10.7270/Q20V8GJ7
					More data for this Ligand-Target Pair