Compile Data Set for Download or QSAR

Found 66 hits with Last Name = 'chen' and Initial = 'zl'   

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
Platelet-activating factor receptor (Homo sapiens (Human))	BDBM50421411 (CHEMBL2304168) Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](OCc3ccc(Cl)cc3)C34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O Show InChI InChI=1S/C27H29ClO10/c1-11-19(30)36-18-17(34-10-12-5-7-13(28)8-6-12)25-15-9-14(23(2,3)4)24(25)16(29)20(31)37-22(24)38-27(25,21(32)35-15)26(11,18)33/h5-8,11,14-18,22,29,33H,9-10H2,1-4H3/t11-,14+,15-,16+,17+,18+,22+,24+,25?,26-,27-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Compound was evaluated for anti-platelet activating factor potency				Bioorg Med Chem Lett 8: 1291-6 (1999) BindingDB Entry DOI: 10.7270/Q2VH5PB6
					More data for this Ligand-Target Pair
Platelet-activating factor receptor (Homo sapiens (Human))	BDBM50421412 (CHEMBL2304167) Show SMILES CC1C(=O)O[C@H]2[C@H](O)C34[C@H]5C[C@@H](C(C)(C)C)[C@]33[C@@H](OC(=O)[C@@H]3OCOCc3ccccc3)O[C@@]4(C(=O)O5)[C@@]12O Show InChI InChI=1S/C28H32O11/c1-13-20(30)37-18-17(29)26-16-10-15(24(2,3)4)25(26)19(35-12-34-11-14-8-6-5-7-9-14)21(31)38-23(25)39-28(26,22(32)36-16)27(13,18)33/h5-9,13,15-19,23,29,33H,10-12H2,1-4H3/t13?,15-,16+,17-,18-,19-,23-,25-,26?,27+,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Compound was evaluated for anti-platelet activating factor potency				Bioorg Med Chem Lett 8: 1291-6 (1999) BindingDB Entry DOI: 10.7270/Q2VH5PB6
					More data for this Ligand-Target Pair
Platelet-activating factor receptor (Homo sapiens (Human))	BDBM50421410 (CHEMBL2304166) Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](OCOCc3ccccc3)C34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O Show InChI InChI=1S/C28H32O11/c1-13-20(30)37-19-18(35-12-34-11-14-8-6-5-7-9-14)26-16-10-15(24(2,3)4)25(26)17(29)21(31)38-23(25)39-28(26,22(32)36-16)27(13,19)33/h5-9,13,15-19,23,29,33H,10-12H2,1-4H3/t13-,15+,16-,17+,18+,19+,23+,25+,26?,27-,28-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Compound was evaluated for anti-platelet activating factor potency				Bioorg Med Chem Lett 8: 1291-6 (1999) BindingDB Entry DOI: 10.7270/Q2VH5PB6
					More data for this Ligand-Target Pair
Platelet-activating factor receptor (Homo sapiens (Human))	BDBM50251276 (BN 52021 | CHEMBL514432 | GINKOLIDE B | Gingkolide...) Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O |r| Show InChI InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9+,10+,11+,15+,17+,18+,19-,20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	128	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Compound was evaluated for anti-platelet activating factor potency				Bioorg Med Chem Lett 8: 1291-6 (1999) BindingDB Entry DOI: 10.7270/Q2VH5PB6
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50259940 (2-[(2E)-3,7-dimethyl-2,6-octadienyl]-6-methyl-2,5-...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-1=[#6]-[#6](=O)-[#6]=[#6](-[#6])-[#6]-1=O |w:8.8,t:10,14| Show InChI InChI=1S/C17H22O2/c1-12(2)6-5-7-13(3)8-9-15-11-16(18)10-14(4)17(15)19/h6,8,10-11H,5,7,9H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank 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
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM32020 (4-[4-(3,4-dihydroxyphenyl)-2,3-dimethyl-butyl]pyro...) Show SMILES CC(Cc1ccc(O)c(O)c1)C(C)Cc1ccc(O)c(O)c1 Show InChI InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair				3D Structure (crystal)
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50259939 (2,8-dimethyl-6-hydroxy-2-(4-methyl-3-pentenyl)-2h-...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]C1([#6])[#8]-c2c(-[#6])cc(-[#8])cc2-[#6]=[#6]1 |c:18| Show InChI InChI=1S/C17H22O2/c1-12(2)6-5-8-17(4)9-7-14-11-15(18)10-13(3)16(14)19-17/h6-7,9-11,18H,5,8H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM17638 (2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...) Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of COX1				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565345 (CHEMBL4778200) Show SMILES CN(C)C1CCN(CC1)C(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c1 Show InChI	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	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50565338 (CHEMBL4787035) Show SMILES NC(=O)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kdelta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50259939 (2,8-dimethyl-6-hydroxy-2-(4-methyl-3-pentenyl)-2h-...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]C1([#6])[#8]-c2c(-[#6])cc(-[#8])cc2-[#6]=[#6]1 |c:18| Show InChI InChI=1S/C17H22O2/c1-12(2)6-5-8-17(4)9-7-14-11-15(18)10-13(3)16(14)19-17/h6-7,9-11,18H,5,8H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of COX1				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50565340 (CHEMBL4794018) Show SMILES C[C@H](NC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1)C(N)=O |r| Show InChI	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	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kdelta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50565335 (CHEMBL4790315) Show SMILES NC(=O)[C@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kdelta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM25045 (3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...) Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1 Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair				3D Structure (crystal)
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565335 (CHEMBL4790315) Show SMILES NC(=O)[C@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565339 (CHEMBL4788806) Show SMILES NC(=O)C1(N)CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565340 (CHEMBL4794018) Show SMILES C[C@H](NC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1)C(N)=O |r| Show InChI	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	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565345 (CHEMBL4778200) Show SMILES CN(C)C1CCN(CC1)C(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c1 Show InChI	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	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565335 (CHEMBL4790315) Show SMILES NC(=O)[C@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565336 (CHEMBL4793222) Show SMILES NC(=O)C1CCCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM25045 (3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...) Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1 Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair				3D Structure (crystal)
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565337 (CHEMBL4777939) Show SMILES NC(=O)C1CCCN(C1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565334 (CHEMBL4786662) Show SMILES NC(=O)[C@@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r| Show InChI	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	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565343 (CHEMBL4782217) Show SMILES CS(=O)(=O)N1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565341 (CHEMBL4778112) Show SMILES O=C(N1CCOCC1)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50565342 (CHEMBL4788677) Show SMILES CN1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kdelta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565342 (CHEMBL4788677) Show SMILES CN1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	1.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565340 (CHEMBL4794018) Show SMILES C[C@H](NC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1)C(N)=O |r| Show InChI	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	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565334 (CHEMBL4786662) Show SMILES NC(=O)[C@@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r| Show InChI	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	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565333 (CHEMBL4793503) Show SMILES CN(C)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565338 (CHEMBL4787035) Show SMILES NC(=O)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50565338 (CHEMBL4787035) Show SMILES NC(=O)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	1.54E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 as substrate measured after 45 mins in presence of ATP by LANCE Ultra assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565341 (CHEMBL4778112) Show SMILES O=C(N1CCOCC1)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50565335 (CHEMBL4790315) Show SMILES NC(=O)[C@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kbeta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50241938 (Atractylon | CHEMBL486189) Show SMILES Cc1coc2C[C@@]3(C)CCCC(=C)[C@@H]3Cc12 |r| Show InChI InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50565345 (CHEMBL4778200) Show SMILES CN(C)C1CCN(CC1)C(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c1 Show InChI	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	2.78E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kbeta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50565342 (CHEMBL4788677) Show SMILES CN1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kbeta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565337 (CHEMBL4777939) Show SMILES NC(=O)C1CCCN(C1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	3.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565339 (CHEMBL4788806) Show SMILES NC(=O)C1(N)CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	3.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50565338 (CHEMBL4787035) Show SMILES NC(=O)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kbeta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50240512 (7-Methoxy-8-(3-methyl-but-2-enyl)-chromen-2-one | ...) Show SMILES [#6]-[#8]-c1ccc2ccc(=O)oc2c1-[#6]\[#6]=[#6](\[#6])-[#6] Show InChI InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50565345 (CHEMBL4778200) Show SMILES CN(C)C1CCN(CC1)C(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c1 Show InChI	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	4.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kgamma (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50565341 (CHEMBL4778112) Show SMILES O=C(N1CCOCC1)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kdelta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565343 (CHEMBL4782217) Show SMILES CS(=O)(=O)N1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	5.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50259940 (2-[(2E)-3,7-dimethyl-2,6-octadienyl]-6-methyl-2,5-...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-1=[#6]-[#6](=O)-[#6]=[#6](-[#6])-[#6]-1=O |w:8.8,t:10,14| Show InChI InChI=1S/C17H22O2/c1-12(2)6-5-7-13(3)8-9-15-11-16(18)10-14(4)17(15)19/h6,8,10-11H,5,7,9H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich-Heine-Universität Düsseldorf Curated by ChEMBL					Assay Description Inhibition of COX1				J Nat Prod 61: 347-50 (1998) Article DOI: 10.1021/np970430b BindingDB Entry DOI: 10.7270/Q2PN95D7
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565332 (CHEMBL4783079) Show SMILES OC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	6.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50565340 (CHEMBL4794018) Show SMILES C[C@H](NC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1)C(N)=O |r| Show InChI	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	7.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kbeta (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565336 (CHEMBL4793222) Show SMILES NC(=O)C1CCCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	7.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50565333 (CHEMBL4793503) Show SMILES CN(C)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50565342 (CHEMBL4788677) Show SMILES CN1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 Show InChI	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	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PI3Kgamma (unknown origin) using PIP2 as substrate measured after 1 hr in presence of ATP by ADP-Glo reagent based assay				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112637 BindingDB Entry DOI: 10.7270/Q2MS3XH5
					More data for this Ligand-Target Pair

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