BDBM50102272 1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,2-a]quinoxalin-5-yl)-ethyl]-thiourea::CHEMBL320557

SMILES: Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1

InChI Key: InChIKey=YOZNRICYONRPFZ-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50102272   

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)	BDBM50102272 (1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,...) Show SMILES Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1 Show InChI InChI=1S/C18H15BrN6OS/c19-12-5-6-15(22-11-12)23-18(27)21-8-10-25-14-4-2-1-3-13(14)24-9-7-20-16(24)17(25)26/h1-7,9,11H,8,10H2,(H2,21,22,23,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	240	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Salerno Curated by ChEMBL					Assay Description Inhibition of HIV-1 Mutant HIV-1 RT enzymes containing the single amino acid substitution K103N				J Med Chem 44: 305-15 (2001) BindingDB Entry DOI: 10.7270/Q2HX1DD9
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50102272 (1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,...) Show SMILES Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1 Show InChI InChI=1S/C18H15BrN6OS/c19-12-5-6-15(22-11-12)23-18(27)21-8-10-25-14-4-2-1-3-13(14)24-9-7-20-16(24)17(25)26/h1-7,9,11H,8,10H2,(H2,21,22,23,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Salerno Curated by ChEMBL					Assay Description Inhibition of HIV-1 wild-type RT				J Med Chem 44: 305-15 (2001) BindingDB Entry DOI: 10.7270/Q2HX1DD9
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50102272 (1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,...) Show SMILES Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1 Show InChI InChI=1S/C18H15BrN6OS/c19-12-5-6-15(22-11-12)23-18(27)21-8-10-25-14-4-2-1-3-13(14)24-9-7-20-16(24)17(25)26/h1-7,9,11H,8,10H2,(H2,21,22,23,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Salerno Curated by ChEMBL					Assay Description Inhibition of HIV-1 Mutant HIV-1 RT enzymes containing the single amino acid substitution V106A				J Med Chem 44: 305-15 (2001) BindingDB Entry DOI: 10.7270/Q2HX1DD9
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50102272 (1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,...) Show SMILES Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1 Show InChI InChI=1S/C18H15BrN6OS/c19-12-5-6-15(22-11-12)23-18(27)21-8-10-25-14-4-2-1-3-13(14)24-9-7-20-16(24)17(25)26/h1-7,9,11H,8,10H2,(H2,21,22,23,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Salerno Curated by ChEMBL					Assay Description Inhibition of HIV-1 Mutant HIV-1 RT enzymes containing the single amino acid substitution L1001				J Med Chem 44: 305-15 (2001) BindingDB Entry DOI: 10.7270/Q2HX1DD9
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50102272 (1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,...) Show SMILES Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1 Show InChI InChI=1S/C18H15BrN6OS/c19-12-5-6-15(22-11-12)23-18(27)21-8-10-25-14-4-2-1-3-13(14)24-9-7-20-16(24)17(25)26/h1-7,9,11H,8,10H2,(H2,21,22,23,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Salerno Curated by ChEMBL					Assay Description Inhibition of HIV-1 Mutant HIV-1 RT enzymes containing the single amino acid substitution Y181I				J Med Chem 44: 305-15 (2001) BindingDB Entry DOI: 10.7270/Q2HX1DD9
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50102272 (1-(5-Bromo-pyridin-2-yl)-3-[2-(4-oxo-4H-imidazo[1,...) Show SMILES Brc1ccc(NC(=S)NCCn2c3ccccc3n3ccnc3c2=O)nc1 Show InChI InChI=1S/C18H15BrN6OS/c19-12-5-6-15(22-11-12)23-18(27)21-8-10-25-14-4-2-1-3-13(14)24-9-7-20-16(24)17(25)26/h1-7,9,11H,8,10H2,(H2,21,22,23,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Salerno Curated by ChEMBL					Assay Description Inhibition of HIV-1 Mutant HIV-1 RT enzymes containing the single amino acid substitution Y188L				J Med Chem 44: 305-15 (2001) BindingDB Entry DOI: 10.7270/Q2HX1DD9
					More data for this Ligand-Target Pair