Compile Data Set for Download or QSAR

Found 26 hits with Last Name = 'macgregor' and Initial = 'ka'   

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
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446548 (CHEMBL3110181) Show SMILES [O-]S(=O)(=O)c1cc2C(=O)N(Cc3ccccc3)C(=O)c3cccc(c1)c23 Show InChI InChI=1S/C19H13NO5S/c21-18-15-8-4-7-13-9-14(26(23,24)25)10-16(17(13)15)19(22)20(18)11-12-5-2-1-3-6-12/h1-10H,11H2,(H,23,24,25)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Dynamin-2 (Rattus norvegicus)	BDBM50055861 (CHEMBL3329968) Show SMILES OC(=O)c1ccc(NC2=CC(=O)C(Nc3ccc(cc3)C(O)=O)=CC2=O)cc1 |c:23,t:8| Show InChI InChI=1S/C20H14N2O6/c23-17-10-16(22-14-7-3-12(4-8-14)20(27)28)18(24)9-15(17)21-13-5-1-11(2-6-13)19(25)26/h1-10,21-22H,(H,25,26)(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of phosphatidylserine-stimulated GTPase activity of recombinant rat Dynamin 2 expressed in Sf21 cells assessed as inhibition of orthophosp...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446549 (CHEMBL3110180) Show SMILES Nc1ccccc1CN1C(=O)c2cccc3cc(cc(C1=O)c23)S([O-])(=O)=O Show InChI InChI=1S/C19H14N2O5S/c20-16-7-2-1-4-12(16)10-21-18(22)14-6-3-5-11-8-13(27(24,25)26)9-15(17(11)14)19(21)23/h1-9H,10,20H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446543 (CHEMBL3110178) Show SMILES [O-]S(=O)(=O)c1cc2C(=O)N(Cc3ccc(Cl)cc3)C(=O)c3cccc(c1)c23 Show InChI InChI=1S/C19H12ClNO5S/c20-13-6-4-11(5-7-13)10-21-18(22)15-3-1-2-12-8-14(27(24,25)26)9-16(17(12)15)19(21)23/h1-9H,10H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446544 (CHEMBL3110188) Show SMILES [O-]S(=O)(=O)c1cc2C(=O)N(Cc3ccc(F)cc3)C(=O)c3cccc(c1)c23 Show InChI InChI=1S/C19H12FNO5S/c20-13-6-4-11(5-7-13)10-21-18(22)15-3-1-2-12-8-14(27(24,25)26)9-16(17(12)15)19(21)23/h1-9H,10H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Dynamin-2 (Rattus norvegicus)	BDBM50055860 (CHEMBL3329967) Show SMILES OC(=O)c1cccc(NC2=CC(=O)C(Nc3cccc(c3)C(O)=O)=CC2=O)c1 |c:24,t:9| Show InChI InChI=1S/C20H14N2O6/c23-17-10-16(22-14-6-2-4-12(8-14)20(27)28)18(24)9-15(17)21-13-5-1-3-11(7-13)19(25)26/h1-10,21-22H,(H,25,26)(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of phosphatidylserine-stimulated GTPase activity of recombinant rat Dynamin 2 expressed in Sf21 cells assessed as inhibition of orthophosp...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446540 (CHEMBL3110184) Show SMILES Cc1ccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C20H15NO5S/c1-12-5-7-13(8-6-12)11-21-19(22)16-4-2-3-14-9-15(27(24,25)26)10-17(18(14)16)20(21)23/h2-10H,11H2,1H3,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446542 (CHEMBL3110179) Show SMILES [O-]S(=O)(=O)c1cc2C(=O)N(Cc3ccc(Br)cc3)C(=O)c3cccc(c1)c23 Show InChI InChI=1S/C19H12BrNO5S/c20-13-6-4-11(5-7-13)10-21-18(22)15-3-1-2-12-8-14(27(24,25)26)9-16(17(12)15)19(21)23/h1-9H,10H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446546 (CHEMBL3110183) Show SMILES COc1ccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C20H15NO6S/c1-27-14-7-5-12(6-8-14)11-21-19(22)16-4-2-3-13-9-15(28(24,25)26)10-17(18(13)16)20(21)23/h2-10H,11H2,1H3,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446551 (CHEMBL3110174) Show SMILES Nc1ccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C19H14N2O5S/c20-13-6-4-11(5-7-13)10-21-18(22)15-3-1-2-12-8-14(27(24,25)26)9-16(17(12)15)19(21)23/h1-9H,10,20H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446547 (CHEMBL3110182) Show SMILES Oc1ccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C19H13NO6S/c21-13-6-4-11(5-7-13)10-20-18(22)15-3-1-2-12-8-14(27(24,25)26)9-16(17(12)15)19(20)23/h1-9,21H,10H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Dynamin-2 (Rattus norvegicus)	BDBM50055859 (CHEMBL3329966) Show SMILES Oc1ccc(NC2=CC(=O)C(Nc3ccc(O)cc3)=CC2=O)cc1 |c:19,t:6| Show InChI InChI=1S/C18H14N2O4/c21-13-5-1-11(2-6-13)19-15-9-18(24)16(10-17(15)23)20-12-3-7-14(22)8-4-12/h1-10,19-22H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of phosphatidylserine-stimulated GTPase activity of recombinant rat Dynamin 2 expressed in Sf21 cells assessed as inhibition of orthophosp...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Dynamin-1 (Homo sapiens (Human))	BDBM50055859 (CHEMBL3329966) Show SMILES Oc1ccc(NC2=CC(=O)C(Nc3ccc(O)cc3)=CC2=O)cc1 |c:19,t:6| Show InChI InChI=1S/C18H14N2O4/c21-13-5-1-11(2-6-13)19-15-9-18(24)16(10-17(15)23)20-12-3-7-14(22)8-4-12/h1-10,19-22H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of Dynamin 1 in serum-starved human U2OS cells assessed as inhibition of clathrin-mediated Alexa-495-cojugated transferrin uptake pretreat...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Dynamin-2 (Rattus norvegicus)	BDBM50055862 (CHEMBL3329969) Show SMILES Oc1cccc(NC2=CC(=O)C(Nc3cccc(O)c3)=CC2=O)c1 |c:20,t:7| Show InChI InChI=1S/C18H14N2O4/c21-13-5-1-3-11(7-13)19-15-9-18(24)16(10-17(15)23)20-12-4-2-6-14(22)8-12/h1-10,19-22H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.37E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of phosphatidylserine-stimulated GTPase activity of recombinant rat Dynamin 2 expressed in Sf21 cells assessed as inhibition of orthophosp...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446553 (CHEMBL3110161) Show SMILES OC(=O)c1ccc(N2C(=O)c3cccc4cc(cc(C2=O)c34)[N+]([O-])=O)c(O)c1 Show InChI InChI=1S/C19H10N2O7/c22-15-7-10(19(25)26)4-5-14(15)20-17(23)12-3-1-2-9-6-11(21(27)28)8-13(16(9)12)18(20)24/h1-8,22H,(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446556 (CHEMBL3110158) Show SMILES Nc1ccc(CN2C(=O)c3cccc4c(N)c(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C19H15N3O5S/c20-11-6-4-10(5-7-11)9-22-18(23)13-3-1-2-12-16(13)14(19(22)24)8-15(17(12)21)28(25,26)27/h1-8H,9,20-21H2,(H,25,26,27)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446545 (CHEMBL3110186) Show SMILES OC(=O)c1ccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C20H13NO7S/c22-18-15-3-1-2-13-8-14(29(26,27)28)9-16(17(13)15)19(23)21(18)10-11-4-6-12(7-5-11)20(24)25/h1-9H,10H2,(H,24,25)(H,26,27,28)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446541 (CHEMBL3110185) Show SMILES CN(C)c1ccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)cc1 Show InChI InChI=1S/C21H18N2O5S/c1-22(2)15-8-6-13(7-9-15)12-23-20(24)17-5-3-4-14-10-16(29(26,27)28)11-18(19(14)17)21(23)25/h3-11H,12H2,1-2H3,(H,26,27,28)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446555 (CHEMBL3110160) Show SMILES CCN1C(=O)c2cccc3c(N)c(cc(C1=O)c23)S([O-])(=O)=O Show InChI InChI=1S/C14H12N2O5S/c1-2-16-13(17)8-5-3-4-7-11(8)9(14(16)18)6-10(12(7)15)22(19,20)21/h3-6H,2,15H2,1H3,(H,19,20,21)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446552 (CHEMBL3110162) Show SMILES OC(=O)c1cc(O)ccc1N1C(=O)c2cccc3cc(cc(C1=O)c23)[N+]([O-])=O Show InChI InChI=1S/C19H10N2O7/c22-11-4-5-15(13(8-11)19(25)26)20-17(23)12-3-1-2-9-6-10(21(27)28)7-14(16(9)12)18(20)24/h1-8,22H,(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446550 (CHEMBL3110177) Show SMILES Nc1cccc(CN2C(=O)c3cccc4cc(cc(C2=O)c34)S([O-])(=O)=O)c1 Show InChI InChI=1S/C19H14N2O5S/c20-13-5-1-3-11(7-13)10-21-18(22)15-6-2-4-12-8-14(27(24,25)26)9-16(17(12)15)19(21)23/h1-9H,10,20H2,(H,24,25,26)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Clathrin heavy chain 1 (Homo sapiens (Human))	BDBM50446554 (CHEMBL3110159) Show SMILES CCCN1C(=O)c2cccc3c(N)c(cc(C1=O)c23)S([O-])(=O)=O Show InChI InChI=1S/C15H14N2O5S/c1-2-6-17-14(18)9-5-3-4-8-12(9)10(15(17)19)7-11(13(8)16)23(20,21)22/h3-5,7H,2,6,16H2,1H3,(H,20,21,22)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of recombinant GST-tagged clathrin heavy chain (unknown origin) after 1 hr by ELISA				J Med Chem 57: 131-43 (2014) Article DOI: 10.1021/jm4015263 BindingDB Entry DOI: 10.7270/Q2HQ41DT
					More data for this Ligand-Target Pair
Dynamin-1 (Homo sapiens (Human))	BDBM50055863 (CHEMBL2252571) Show SMILES O=C1C=C(NCc2ccccc2)C(=O)C=C1NCc1ccccc1 |c:15,t:2| Show InChI InChI=1S/C20H18N2O2/c23-19-12-18(22-14-16-9-5-2-6-10-16)20(24)11-17(19)21-13-15-7-3-1-4-8-15/h1-12,21-22H,13-14H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of Dynamin 1 in serum-starved human U2OS cells assessed as inhibition of clathrin-mediated Alexa-495-cojugated transferrin uptake pretreat...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Dynamin-1 (Homo sapiens (Human))	BDBM50266767 (2,2'-(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis(az...) Show SMILES OC(=O)c1ccccc1NC1=CC(=O)C(Nc2ccccc2C(O)=O)=CC1=O |c:26,t:11| Show InChI InChI=1S/C20H14N2O6/c23-17-10-16(22-14-8-4-2-6-12(14)20(27)28)18(24)9-15(17)21-13-7-3-1-5-11(13)19(25)26/h1-10,21-22H,(H,25,26)(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.62E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of Dynamin 1 in serum-starved human U2OS cells assessed as inhibition of clathrin-mediated Alexa-495-cojugated transferrin uptake pretreat...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Dynamin-1 (Homo sapiens (Human))	BDBM50055861 (CHEMBL3329968) Show SMILES OC(=O)c1ccc(NC2=CC(=O)C(Nc3ccc(cc3)C(O)=O)=CC2=O)cc1 |c:23,t:8| Show InChI InChI=1S/C20H14N2O6/c23-17-10-16(22-14-7-3-12(4-8-14)20(27)28)18(24)9-15(17)21-13-5-1-11(2-6-13)19(25)26/h1-10,21-22H,(H,25,26)(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of Dynamin 1 in serum-starved human U2OS cells assessed as inhibition of clathrin-mediated Alexa-495-cojugated transferrin uptake pretreat...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair
Dynamin-1 (Homo sapiens (Human))	BDBM50055860 (CHEMBL3329967) Show SMILES OC(=O)c1cccc(NC2=CC(=O)C(Nc3cccc(c3)C(O)=O)=CC2=O)c1 |c:24,t:9| Show InChI InChI=1S/C20H14N2O6/c23-17-10-16(22-14-6-2-4-12(8-14)20(27)28)18(24)9-15(17)21-13-5-1-3-11(7-13)19(25)26/h1-10,21-22H,(H,25,26)(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Newcastle Curated by ChEMBL					Assay Description Inhibition of Dynamin 1 in serum-starved human U2OS cells assessed as inhibition of clathrin-mediated Alexa-495-cojugated transferrin uptake pretreat...				Eur J Med Chem 85: 191-206 (2014) Article DOI: 10.1016/j.ejmech.2014.06.070 BindingDB Entry DOI: 10.7270/Q28G8NCR
					More data for this Ligand-Target Pair