Compile Data Set for Download or QSAR

Found 9 hits with Last Name = 'hasan' and Initial = 'sm'   

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
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50510873 (CHEMBL4436337) Show SMILES COc1cc2ncnc(Nc3cccc(NC(=O)C=C)c3)c2cc1OCCN1CCOCC1 Show InChI InChI=1S/C24H27N5O4/c1-3-23(30)27-17-5-4-6-18(13-17)28-24-19-14-22(21(31-2)15-20(19)25-16-26-24)33-12-9-29-7-10-32-11-8-29/h3-6,13-16H,1,7-12H2,2H3,(H,27,30)(H,25,26,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard Curated by ChEMBL					Assay Description Inhibition of EGFR T790M mutant (unknown origin) incubated for 60 mins by ADP-Glo kinase assay				Eur J Med Chem 167: 324-356 (2019) Article DOI: 10.1016/j.ejmech.2019.02.015 BindingDB Entry DOI: 10.7270/Q2CR5XPN
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM233052 (3-(2,6-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2c(Cl)cccc2Cl)C(=O)O1 |t:11| Show InChI InChI=1S/C21H18Cl2O2/c1-13(2)10-14-6-8-15(9-7-14)20-12-16(21(24)25-20)11-17-18(22)4-3-5-19(17)23/h3-9,11-13H,10H2,1-2H3/b16-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM233053 (3-(2,4-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2ccc(Cl)cc2Cl)C(=O)O1 |t:11| Show InChI InChI=1S/C21H18Cl2O2/c1-13(2)9-14-3-5-15(6-4-14)20-11-17(21(24)25-20)10-16-7-8-18(22)12-19(16)23/h3-8,10-13H,9H2,1-2H3/b17-10+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM233050 (3-(2-Chlorobenzylidene)-5-(4-isobutylphenyl)-2(3H)...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2ccccc2Cl)C(=O)O1 |t:11| Show InChI InChI=1S/C21H19ClO2/c1-14(2)11-15-7-9-16(10-8-15)20-13-18(21(23)24-20)12-17-5-3-4-6-19(17)22/h3-10,12-14H,11H2,1-2H3/b18-12+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM233051 (3-(4-Fluorobenzylidene)-5-(4-isobutylphenyl)-2(3H)...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2ccc(F)cc2)C(=O)O1 |t:11| Show InChI InChI=1S/C21H19FO2/c1-14(2)11-15-3-7-17(8-4-15)20-13-18(21(23)24-20)12-16-5-9-19(22)10-6-16/h3-10,12-14H,11H2,1-2H3/b18-12+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM233052 (3-(2,6-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2c(Cl)cccc2Cl)C(=O)O1 |t:11| Show InChI InChI=1S/C21H18Cl2O2/c1-13(2)10-14-6-8-15(9-7-14)20-12-16(21(24)25-20)11-17-18(22)4-3-5-19(17)23/h3-9,11-13H,10H2,1-2H3/b16-11+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM233053 (3-(2,4-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2ccc(Cl)cc2Cl)C(=O)O1 |t:11| Show InChI InChI=1S/C21H18Cl2O2/c1-13(2)9-14-3-5-15(6-4-14)20-11-17(21(24)25-20)10-16-7-8-18(22)12-19(16)23/h3-8,10-13H,9H2,1-2H3/b17-10+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM233050 (3-(2-Chlorobenzylidene)-5-(4-isobutylphenyl)-2(3H)...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2ccccc2Cl)C(=O)O1 |t:11| Show InChI InChI=1S/C21H19ClO2/c1-14(2)11-15-7-9-16(10-8-15)20-13-18(21(23)24-20)12-17-5-3-4-6-19(17)22/h3-10,12-14H,11H2,1-2H3/b18-12+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM233051 (3-(4-Fluorobenzylidene)-5-(4-isobutylphenyl)-2(3H)...) Show SMILES CC(C)Cc1ccc(cc1)C1=C\C(=C/c2ccc(F)cc2)C(=O)O1 |t:11| Show InChI InChI=1S/C21H19FO2/c1-14(2)11-15-3-7-17(8-4-15)20-13-18(21(23)24-20)12-16-5-9-19(22)10-6-16/h3-10,12-14H,11H2,1-2H3/b18-12+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard					Assay Description Inhibition of the enzymes was determined using an enzyme immunoassay (EIA) kit (catalog no. 560101, Cayman Chemical, Ann Arbor, MI, USA) according to...				J Enzyme Inhib Med Chem 25: 323-30 (2010) Article DOI: 10.3109/14756360903179435 BindingDB Entry DOI: 10.7270/Q26H4G8J
					More data for this Ligand-Target Pair