Compile Data Set for Download or QSAR

Found 92 hits with Last Name = 'mostafa' and Initial = 's'   

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
Dual specificity mitogen-activated protein kinase kinase 1 (Homo sapiens (Human))	BDBM50531540 (CHEBI:75998 | GSK-1120212 | GSK1120212 | JTP 74057...) Show SMILES CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O Show InChI InChI=1S/C26H23FIN5O4/c1-13-22-21(23(31(3)24(13)35)30-20-10-7-15(28)11-19(20)27)25(36)33(17-8-9-17)26(37)32(22)18-6-4-5-16(12-18)29-14(2)34/h4-7,10-12,17,30H,8-9H2,1-3H3,(H,29,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of MEK1 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50363397 (CHEMBL1946170 | REGORAFENIB | US10183928, Regorafe...) Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c(F)c2)ccn1 Show InChI InChI=1S/C21H15ClF4N4O3/c1-27-19(31)18-10-13(6-7-28-18)33-12-3-5-17(16(23)9-12)30-20(32)29-11-2-4-15(22)14(8-11)21(24,25)26/h2-10H,1H3,(H,27,31)(H2,29,30,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 2 (Homo sapiens (Human))	BDBM50531540 (CHEBI:75998 | GSK-1120212 | GSK1120212 | JTP 74057...) Show SMILES CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O Show InChI InChI=1S/C26H23FIN5O4/c1-13-22-21(23(31(3)24(13)35)30-20-10-7-15(28)11-19(20)27)25(36)33(17-8-9-17)26(37)32(22)18-6-4-5-16(12-18)29-14(2)34/h4-7,10-12,17,30H,8-9H2,1-3H3,(H,29,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of MEK2 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535309 (CHEMBL4582195) Show SMILES O=C(CSC(=S)N1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H22N4O2S2/c25-18(14-28-20(27)24-11-4-1-5-12-24)22-15-7-6-8-16(13-15)23-19(26)17-9-2-3-10-21-17/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,22,25)(H,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM26474 (5-({4-[(2,3-dimethyl-2H-indazol-6-yl)(methyl)amino...) Show SMILES CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1 Show InChI InChI=1S/C21H23N7O2S/c1-13-5-6-15(11-19(13)31(22,29)30)24-21-23-10-9-20(25-21)27(3)16-7-8-17-14(2)28(4)26-18(17)12-16/h5-12H,1-4H3,(H2,22,29,30)(H,23,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM21 (CHEMBL24828 | N-(4-bromo-2-fluorophenyl)-6-methoxy...) Show SMILES COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1 Show InChI InChI=1S/C22H24BrFN4O2/c1-28-7-5-14(6-8-28)12-30-21-11-19-16(10-20(21)29-2)22(26-13-25-19)27-18-4-3-15(23)9-17(18)24/h3-4,9-11,13-14H,5-8,12H2,1-2H3,(H,25,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50535325 (CHEMBL4437943) Show SMILES O=C(CCSC(=S)N1CCN(CC1)c1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C26H27N5O2S2/c32-24(28-20-7-6-8-21(19-20)29-25(33)23-11-4-5-13-27-23)12-18-35-26(34)31-16-14-30(15-17-31)22-9-2-1-3-10-22/h1-11,13,19H,12,14-18H2,(H,28,32)(H,29,33)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human HER2 in human A549 cells by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM16673 (4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamo...) Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1 Show InChI InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged EGFR (695 to end) expressed in baculovirus infected Sf9 cells using ATP as substrate after 40 m...				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50535314 (CHEMBL4437803) Show SMILES O=C(NC1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C19H22N4O2/c24-18(17-11-4-5-12-20-17)21-15-9-6-10-16(13-15)23-19(25)22-14-7-2-1-3-8-14/h4-6,9-14H,1-3,7-8H2,(H,21,24)(H2,22,23,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human HER2 in human A549 cells by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM5446 (CHEMBL553 | ERLOTINIB HYDROCHLORIDE | Erlotinib | ...) Show SMILES COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC Show InChI InChI=1S/C22H23N3O4/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human HER2 in human A549 cells by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50535325 (CHEMBL4437943) Show SMILES O=C(CCSC(=S)N1CCN(CC1)c1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C26H27N5O2S2/c32-24(28-20-7-6-8-21(19-20)29-25(33)23-11-4-5-13-27-23)12-18-35-26(34)31-16-14-30(15-17-31)22-9-2-1-3-10-22/h1-11,13,19H,12,14-18H2,(H,28,32)(H,29,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged EGFR (695 to end) expressed in baculovirus infected Sf9 cells using ATP as substrate after 40 m...				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM4814 (CHEMBL535 | N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fl...) Show SMILES CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C Show InChI InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50535309 (CHEMBL4582195) Show SMILES O=C(CSC(=S)N1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H22N4O2S2/c25-18(14-28-20(27)24-11-4-1-5-12-24)22-15-7-6-8-16(13-15)23-19(26)17-9-2-3-10-21-17/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,22,25)(H,23,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged EGFR (695 to end) expressed in baculovirus infected Sf9 cells using ATP as substrate after 40 m...				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535314 (CHEMBL4437803) Show SMILES O=C(NC1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C19H22N4O2/c24-18(17-11-4-5-12-20-17)21-15-9-6-10-16(13-15)23-19(25)22-14-7-2-1-3-8-14/h4-6,9-14H,1-3,7-8H2,(H,21,24)(H2,22,23,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM16673 (4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamo...) Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1 Show InChI InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535325 (CHEMBL4437943) Show SMILES O=C(CCSC(=S)N1CCN(CC1)c1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C26H27N5O2S2/c32-24(28-20-7-6-8-21(19-20)29-25(33)23-11-4-5-13-27-23)12-18-35-26(34)31-16-14-30(15-17-31)22-9-2-1-3-10-22/h1-11,13,19H,12,14-18H2,(H,28,32)(H,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535323 (CHEMBL4543044) Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC(=O)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C24H29N5O4S2/c1-24(2,3)33-22(32)28-11-13-29(14-12-28)23(34)35-16-20(30)26-17-7-6-8-18(15-17)27-21(31)19-9-4-5-10-25-19/h4-10,15H,11-14,16H2,1-3H3,(H,26,30)(H,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535330 (CHEMBL4466088) Show SMILES O=C(CSC(=S)N1CCN(CC1)c1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C25H25N5O2S2/c31-23(18-34-25(33)30-15-13-29(14-16-30)21-9-2-1-3-10-21)27-19-7-6-8-20(17-19)28-24(32)22-11-4-5-12-26-22/h1-12,17H,13-16,18H2,(H,27,31)(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535318 (CHEMBL4584717) Show SMILES O=C(Nc1cccc(NC(=S)Nc2ccccc2)c1)c1ccccn1 Show InChI InChI=1S/C19H16N4OS/c24-18(17-11-4-5-12-20-17)21-15-9-6-10-16(13-15)23-19(25)22-14-7-2-1-3-8-14/h1-13H,(H,21,24)(H2,22,23,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50535309 (CHEMBL4582195) Show SMILES O=C(CSC(=S)N1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H22N4O2S2/c25-18(14-28-20(27)24-11-4-1-5-12-24)22-15-7-6-8-16(13-15)23-19(26)17-9-2-3-10-21-17/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,22,25)(H,23,26)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	104	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human HER2 in human A549 cells by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535324 (CHEMBL4443510) Show SMILES O=C(CCSC(=S)N1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C21H24N4O2S2/c26-19(10-14-29-21(28)25-12-4-1-5-13-25)23-16-7-6-8-17(15-16)24-20(27)18-9-2-3-11-22-18/h2-3,6-9,11,15H,1,4-5,10,12-14H2,(H,23,26)(H,24,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535327 (CHEMBL4521454) Show SMILES Clc1ccc(NC(=O)Nc2cccc(NC(=O)c3ccccn3)c2)cc1 Show InChI InChI=1S/C19H15ClN4O2/c20-13-7-9-14(10-8-13)23-19(26)24-16-5-3-4-15(12-16)22-18(25)17-6-1-2-11-21-17/h1-12H,(H,22,25)(H2,23,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	115	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535313 (CHEMBL4536372) Show SMILES [O-][N+](=O)c1ccc(NC(=O)Nc2cccc(NC(=O)c3ccccn3)c2)cc1 Show InChI InChI=1S/C19H15N5O4/c25-18(17-6-1-2-11-20-17)21-14-4-3-5-15(12-14)23-19(26)22-13-7-9-16(10-8-13)24(27)28/h1-12H,(H,21,25)(H2,22,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50535314 (CHEMBL4437803) Show SMILES O=C(NC1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C19H22N4O2/c24-18(17-11-4-5-12-20-17)21-15-9-6-10-16(13-15)23-19(25)22-14-7-2-1-3-8-14/h4-6,9-14H,1-3,7-8H2,(H,21,24)(H2,22,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	147	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged EGFR (695 to end) expressed in baculovirus infected Sf9 cells using ATP as substrate after 40 m...				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535316 (CHEMBL4558158) Show SMILES Cc1ccc(NC(=O)Nc2cccc(NC(=O)c3ccccn3)c2)cc1 Show InChI InChI=1S/C20H18N4O2/c1-14-8-10-15(11-9-14)23-20(26)24-17-6-4-5-16(13-17)22-19(25)18-7-2-3-12-21-18/h2-13H,1H3,(H,22,25)(H2,23,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535321 (CHEMBL4513911) Show SMILES O=C(CSC(=S)N1CCN(CC1)C1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C25H31N5O2S2/c31-23(18-34-25(33)30-15-13-29(14-16-30)21-9-2-1-3-10-21)27-19-7-6-8-20(17-19)28-24(32)22-11-4-5-12-26-22/h4-8,11-12,17,21H,1-3,9-10,13-16,18H2,(H,27,31)(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM16673 (4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamo...) Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1 Show InChI InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535319 (CHEMBL4449758) Show SMILES [O-][N+](=O)c1ccc(NC(=S)Nc2cccc(NC(=O)c3ccccn3)c2)cc1 Show InChI InChI=1S/C19H15N5O3S/c25-18(17-6-1-2-11-20-17)21-14-4-3-5-15(12-14)23-19(28)22-13-7-9-16(10-8-13)24(26)27/h1-12H,(H,21,25)(H2,22,23,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216514 (4-(3-hydroxyphenyl)-7,7-dimethyl-2-thioxo-1,2,3,4,...) Show SMILES CC1(C)CC(=O)C2C(NC(=S)N=C2C1)c1cccc(O)c1 |w:7.15,c:11| Show InChI InChI=1S/C16H18N2O2S/c1-16(2)7-11-13(12(20)8-16)14(18-15(21)17-11)9-4-3-5-10(19)6-9/h3-6,13-14,19H,7-8H2,1-2H3,(H,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human Eg5				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair				3D Structure (docked)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535326 (CHEMBL4529255) Show SMILES O=C(CCSC(=S)N1CCOCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H22N4O3S2/c25-18(7-13-29-20(28)24-9-11-27-12-10-24)22-15-4-3-5-16(14-15)23-19(26)17-6-1-2-8-21-17/h1-6,8,14H,7,9-13H2,(H,22,25)(H,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535320 (CHEMBL4467322) Show SMILES O=C(CSC(=S)N1CCOCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C19H20N4O3S2/c24-17(13-28-19(27)23-8-10-26-11-9-23)21-14-4-3-5-15(12-14)22-18(25)16-6-1-2-7-20-16/h1-7,12H,8-11,13H2,(H,21,24)(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	221	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535322 (CHEMBL4570460) Show SMILES C=CCN1CCN(CC1)C(=S)SCC(=O)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C22H25N5O2S2/c1-2-10-26-11-13-27(14-12-26)22(30)31-16-20(28)24-17-6-5-7-18(15-17)25-21(29)19-8-3-4-9-23-19/h2-9,15H,1,10-14,16H2,(H,24,28)(H,25,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	286	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535331 (CHEMBL4465496) Show SMILES O=C(CSC(=S)N1CCN(CC1)c1ncccn1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C23H23N7O2S2/c31-20(16-34-23(33)30-13-11-29(12-14-30)22-25-9-4-10-26-22)27-17-5-3-6-18(15-17)28-21(32)19-7-1-2-8-24-19/h1-10,15H,11-14,16H2,(H,27,31)(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	302	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535310 (CHEMBL4436488) Show SMILES Clc1cccc(NC(=O)Nc2cccc(NC(=O)c3ccccn3)c2)c1 Show InChI InChI=1S/C19H15ClN4O2/c20-13-5-3-6-14(11-13)23-19(26)24-16-8-4-7-15(12-16)22-18(25)17-9-1-2-10-21-17/h1-12H,(H,22,25)(H2,23,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	319	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM16673 (4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamo...) Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1 Show InChI InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR-2 incubated for 2.5 hrs by ELISA				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535312 (CHEMBL4469407) Show SMILES O=C(CCSC(=S)N1CCN(CC1)c1ncccn1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C24H25N7O2S2/c32-21(28-18-5-3-6-19(17-18)29-22(33)20-7-1-2-9-25-20)8-16-35-24(34)31-14-12-30(13-15-31)23-26-10-4-11-27-23/h1-7,9-11,17H,8,12-16H2,(H,28,32)(H,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	396	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM36609 (Rapamycin C-7, analog 4 | SIROLIMUS | US11603377, ...) Show SMILES CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O |c:14,33,t:29,31| Show InChI InChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12+,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of mTOR (unknown origin) incubated for 1 hr by ELISA				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair				3D Structure (crystal)
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50468599 (CHEMBL4291192) Show SMILES CCOC(=O)C1=C(CSC(=S)N(C2CCCCC2)C2CCCCC2)N(C)C(=O)NC1c1ccccc1 |c:5| Show InChI InChI=1S/C28H39N3O3S2/c1-3-34-26(32)24-23(30(2)27(33)29-25(24)20-13-7-4-8-14-20)19-36-28(35)31(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4,7-8,13-14,21-22,25H,3,5-6,9-12,15-19H2,1-2H3,(H,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of mTOR (unknown origin) incubated for 1 hr by ELISA				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535317 (CHEMBL4517008) Show SMILES O=C(Nc1cccc(NC(=O)c2ccccn2)c1)Nc1ccc2ccccc2c1 Show InChI InChI=1S/C23H18N4O2/c28-22(21-10-3-4-13-24-21)25-18-8-5-9-19(15-18)26-23(29)27-20-12-11-16-6-1-2-7-17(16)14-20/h1-15H,(H,25,28)(H2,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50468598 (CHEMBL4286023) Show SMILES CCOC(=O)C1=C(CSc2nc3cc(ccc3[nH]2)[N+]([O-])=O)N(C)C(=O)NC1c1ccccc1 |c:5| Show InChI InChI=1S/C22H21N5O5S/c1-3-32-20(28)18-17(26(2)22(29)25-19(18)13-7-5-4-6-8-13)12-33-21-23-15-10-9-14(27(30)31)11-16(15)24-21/h4-11,19H,3,12H2,1-2H3,(H,23,24)(H,25,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of mTOR (unknown origin) incubated for 1 hr by ELISA				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535315 (CHEMBL4516917) Show SMILES O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C19H16N4O2/c24-18(17-11-4-5-12-20-17)21-15-9-6-10-16(13-15)23-19(25)22-14-7-2-1-3-8-14/h1-13H,(H,21,24)(H2,22,23,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	753	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535311 (CHEMBL4438721) Show SMILES CN1CCN(CC1)C(=S)SCC(=O)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H23N5O2S2/c1-24-9-11-25(12-10-24)20(28)29-14-18(26)22-15-5-4-6-16(13-15)23-19(27)17-7-2-3-8-21-17/h2-8,13H,9-12,14H2,1H3,(H,22,26)(H,23,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	772	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535329 (CHEMBL4440653) Show SMILES CCN1CCN(CC1)C(=S)SCC(=O)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C21H25N5O2S2/c1-2-25-10-12-26(13-11-25)21(29)30-15-19(27)23-16-6-5-7-17(14-16)24-20(28)18-8-3-4-9-22-18/h3-9,14H,2,10-13,15H2,1H3,(H,23,27)(H,24,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50468598 (CHEMBL4286023) Show SMILES CCOC(=O)C1=C(CSc2nc3cc(ccc3[nH]2)[N+]([O-])=O)N(C)C(=O)NC1c1ccccc1 |c:5| Show InChI InChI=1S/C22H21N5O5S/c1-3-32-20(28)18-17(26(2)22(29)25-19(18)13-7-5-4-6-8-13)12-33-21-23-15-10-9-14(27(30)31)11-16(15)24-21/h4-11,19H,3,12H2,1-2H3,(H,23,24)(H,25,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR-2 incubated for 2.5 hrs by ELISA				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Mer (Homo sapiens (Human))	BDBM16673 (4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamo...) Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1 Show InChI InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human MER incubated for 90 mins by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50535328 (CHEMBL4567879) Show SMILES O=C(NCc1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H18N4O2/c25-19(18-11-4-5-12-21-18)23-16-9-6-10-17(13-16)24-20(26)22-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,23,25)(H2,22,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.73E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR2 in human A549 cells incubated for over night by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50468599 (CHEMBL4291192) Show SMILES CCOC(=O)C1=C(CSC(=S)N(C2CCCCC2)C2CCCCC2)N(C)C(=O)NC1c1ccccc1 |c:5| Show InChI InChI=1S/C28H39N3O3S2/c1-3-34-26(32)24-23(30(2)27(33)29-25(24)20-13-7-4-8-14-20)19-36-28(35)31(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4,7-8,13-14,21-22,25H,3,5-6,9-12,15-19H2,1-2H3,(H,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human VEGFR-2 incubated for 2.5 hrs by ELISA				Eur J Med Chem 156: 304-315 (2018) Article DOI: 10.1016/j.ejmech.2018.07.004 BindingDB Entry DOI: 10.7270/Q2J9692K
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Mer (Homo sapiens (Human))	BDBM50535314 (CHEMBL4437803) Show SMILES O=C(NC1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C19H22N4O2/c24-18(17-11-4-5-12-20-17)21-15-9-6-10-16(13-15)23-19(25)22-14-7-2-1-3-8-14/h4-6,9-14H,1-3,7-8H2,(H,21,24)(H2,22,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human MER incubated for 90 mins by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Mer (Homo sapiens (Human))	BDBM50535325 (CHEMBL4437943) Show SMILES O=C(CCSC(=S)N1CCN(CC1)c1ccccc1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C26H27N5O2S2/c32-24(28-20-7-6-8-21(19-20)29-25(33)23-11-4-5-13-27-23)12-18-35-26(34)31-16-14-30(15-17-31)22-9-2-1-3-10-22/h1-11,13,19H,12,14-18H2,(H,28,32)(H,29,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human MER incubated for 90 mins by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Mer (Homo sapiens (Human))	BDBM50535309 (CHEMBL4582195) Show SMILES O=C(CSC(=S)N1CCCCC1)Nc1cccc(NC(=O)c2ccccn2)c1 Show InChI InChI=1S/C20H22N4O2S2/c25-18(14-28-20(27)24-11-4-1-5-12-24)22-15-7-6-8-16(13-15)23-19(26)17-9-2-3-10-21-17/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,22,25)(H,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.95E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mansoura University Curated by ChEMBL					Assay Description Inhibition of human MER incubated for 90 mins by ELISA method				Eur J Med Chem 168: 315-329 (2019) Article DOI: 10.1016/j.ejmech.2019.02.050 BindingDB Entry DOI: 10.7270/Q28W3HSQ
					More data for this Ligand-Target Pair

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