Compile Data Set for Download or QSAR

Found 14 hits with Last Name = 'rakhman' and Initial = 'i'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81383 (Oxyquinoline, D2, #8) Show SMILES Oc1cccnc1NC(c1ccc(Cl)cc1)c1ccc2cccnc2c1O Show InChI InChI=1S/C21H16ClN3O2/c22-15-8-5-14(6-9-15)18(25-21-17(26)4-2-12-24-21)16-10-7-13-3-1-11-23-19(13)20(16)27/h1-12,18,26-27H,(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81388 (Oxyquinoline, D3, #4) Show SMILES COc1ccc(cc1OC)C(NC(=O)CC(C)C)c1ccc2cccnc2c1O Show InChI InChI=1S/C23H26N2O4/c1-14(2)12-20(26)25-21(16-8-10-18(28-3)19(13-16)29-4)17-9-7-15-6-5-11-24-22(15)23(17)27/h5-11,13-14,21,27H,12H2,1-4H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81389 (Oxyquinoline, D3, #7) Show SMILES COc1ccc(cc1OC)C(NC(=O)Cc1ccccc1)c1ccc2cccnc2c1O Show InChI InChI=1S/C26H24N2O4/c1-31-21-13-11-19(16-22(21)32-2)24(28-23(29)15-17-7-4-3-5-8-17)20-12-10-18-9-6-14-27-25(18)26(20)30/h3-14,16,24,30H,15H2,1-2H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81387 (Oxyquinoline, D3, #1 | cid_3129250) Show SMILES CCCCC(=O)NC(c1ccc(OC)c(OC)c1)c1ccc2cccnc2c1O Show InChI InChI=1S/C23H26N2O4/c1-4-5-8-20(26)25-21(16-10-12-18(28-2)19(14-16)29-3)17-11-9-15-7-6-13-24-22(15)23(17)27/h6-7,9-14,21,27H,4-5,8H2,1-3H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81390 (Oxyquinoline, D3, #6) Show SMILES CCCCC(=O)NC(c1cccc(c1)N(=O)=O)c1ccc2cccnc2c1O Show InChI InChI=1S/C21H21N3O4/c1-2-3-9-18(25)23-19(15-6-4-8-16(13-15)24(27)28)17-11-10-14-7-5-12-22-20(14)21(17)26/h4-8,10-13,19,26H,2-3,9H2,1H3,(H,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81382 (Oxyquinoline, D2, #12) Show SMILES Cc1cccc(NC(c2ccccn2)c2ccc3ccc(C)nc3c2O)n1 Show InChI InChI=1S/C22H20N4O/c1-14-6-5-8-19(24-14)26-21(18-7-3-4-13-23-18)17-12-11-16-10-9-15(2)25-20(16)22(17)27/h3-13,21,27H,1-2H3,(H,24,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM66087 (2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methyl-2-p...) Show SMILES Cc1cc(C2CCCCC2)n(O)c(=O)c1 Show InChI InChI=1S/C12H17NO2/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81385 (Oxyquinoline, D2, #13) Show SMILES Cc1ccnc(NC(c2ccc3OCOc3c2)c2ccc3cccnc3c2O)c1 Show InChI InChI=1S/C23H19N3O3/c1-14-8-10-24-20(11-14)26-21(16-5-7-18-19(12-16)29-13-28-18)17-6-4-15-3-2-9-25-22(15)23(17)27/h2-12,21,27H,13H2,1H3,(H,24,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM52237 (2-methyl-7-[phenyl-(2-pyridinylamino)methyl]-8-qui...) Show SMILES Cc1ccc2ccc(C(Nc3ccccn3)c3ccccc3)c(O)c2n1 Show InChI InChI=1S/C22H19N3O/c1-15-10-11-17-12-13-18(22(26)21(17)24-15)20(16-7-3-2-4-8-16)25-19-9-5-6-14-23-19/h2-14,20,26H,1H3,(H,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81380 (Oxyquinoline, D1, #10) Show SMILES Oc1c(ccc2cccnc12)C(N1CCCCC1)c1ccncc1 Show InChI InChI=1S/C20H21N3O/c24-20-17(7-6-15-5-4-10-22-18(15)20)19(16-8-11-21-12-9-16)23-13-2-1-3-14-23/h4-12,19,24H,1-3,13-14H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81381 (Oxyquinoline, D2, #9) Show SMILES Cc1ccc2ccc(C(Nc3ccccn3)c3cccnc3)c(O)c2n1 Show InChI InChI=1S/C21H18N4O/c1-14-7-8-15-9-10-17(21(26)20(15)24-14)19(16-5-4-11-22-13-16)25-18-6-2-3-12-23-18/h2-13,19,26H,1H3,(H,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81386 (Oxyquinoline, D2, #2) Show SMILES Cc1cccc(NC(c2ccc3OCOc3c2)c2ccc3ccc(C)nc3c2O)n1 Show InChI InChI=1S/C24H21N3O3/c1-14-4-3-5-21(25-14)27-22(17-9-11-19-20(12-17)30-13-29-19)18-10-8-16-7-6-15(2)26-23(16)24(18)28/h3-12,22,28H,13H2,1-2H3,(H,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81391 (Oxyquinoline, D3, #11) Show SMILES CCC(=O)NC(c1ccc2OCOc2c1)c1cc(c2cccnc2c1O)N(=O)=O Show InChI InChI=1S/C20H17N3O6/c1-2-17(24)22-18(11-5-6-15-16(8-11)29-10-28-15)13-9-14(23(26)27)12-4-3-7-21-19(12)20(13)25/h3-9,18,25H,2,10H2,1H3,(H,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM81384 (Oxyquinoline, D2, #3) Show SMILES COc1ccc(cc1OC)C(Nc1ccccn1)c1ccc2ccc(C)nc2c1O Show InChI InChI=1S/C24H23N3O3/c1-15-7-8-16-9-11-18(24(28)23(16)26-15)22(27-21-6-4-5-13-25-21)17-10-12-19(29-2)20(14-17)30-3/h4-14,22,28H,1-3H3,(H,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Medical College of Cornell University					Assay Description The predication of no specific interaction between enzyme and iron-binding inhibitors but the Enzyme inhibition constants (IC50s)will change in paral...				Chem Biol 17: 380-91 (2010) Article DOI: 10.1016/j.chembiol.2010.03.008 BindingDB Entry DOI: 10.7270/Q20K271K
					More data for this Ligand-Target Pair