Found 59 hits of Enzyme Inhibition Constant Data 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 |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388032
(CHEMBL2059165 | US10544104, Compound 91)Show SMILES O=C(NCCC1CCCNC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C22H25N5O2/c28-20(16-6-2-1-3-7-16)17-8-9-18-19(13-17)26-21(25-18)27-22(29)24-12-10-15-5-4-11-23-14-15/h1-3,6-9,13,15,23H,4-5,10-12,14H2,(H3,24,25,26,27,29) | 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 | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50383378
(CHEMBL2030561)Show InChI InChI=1S/C20H22N4O/c21-20-23-17-7-6-16(19(25)15-4-2-1-3-5-15)12-18(17)24(20)13-14-8-10-22-11-9-14/h1-7,12,14,22H,8-11,13H2,(H2,21,23) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388038
(CHEMBL2059171)Show SMILES O=C(CCCC1CCNCC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C23H26N4O2/c28-21(8-4-5-16-11-13-24-14-12-16)27-23-25-19-10-9-18(15-20(19)26-23)22(29)17-6-2-1-3-7-17/h1-3,6-7,9-10,15-16,24H,4-5,8,11-14H2,(H2,25,26,27,28) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388047
(CHEMBL2059176)Show InChI InChI=1S/C21H24N4O/c22-21-24-18-7-6-17(20(26)16-4-2-1-3-5-16)14-19(18)25(21)13-10-15-8-11-23-12-9-15/h1-7,14-15,23H,8-13H2,(H2,22,24) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388035
(CHEMBL2059168)Show SMILES NCCCCCCC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C21H24N4O2/c22-13-7-2-1-6-10-19(26)25-21-23-17-12-11-16(14-18(17)24-21)20(27)15-8-4-3-5-9-15/h3-5,8-9,11-12,14H,1-2,6-7,10,13,22H2,(H2,23,24,25,26) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388041
(CHEMBL2059353)Show SMILES Nc1nc2ccc(cc2n1CC[C@@H]1CCCN1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H22N4O/c21-20-23-17-9-8-15(19(25)14-5-2-1-3-6-14)13-18(17)24(20)12-10-16-7-4-11-22-16/h1-3,5-6,8-9,13,16,22H,4,7,10-12H2,(H2,21,23)/t16-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388040
(CHEMBL2059177)Show SMILES CN1CCC(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C22H26N4O/c1-25-12-9-16(10-13-25)11-14-26-20-15-18(7-8-19(20)24-22(26)23)21(27)17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H2,23,24) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388037
(CHEMBL2059170)Show SMILES O=C(CCC1CCNCC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C22H24N4O2/c27-20(9-6-15-10-12-23-13-11-15)26-22-24-18-8-7-17(14-19(18)25-22)21(28)16-4-2-1-3-5-16/h1-5,7-8,14-15,23H,6,9-13H2,(H2,24,25,26,27) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388042
(CHEMBL2059361)Show SMILES CN1CCN(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C21H25N5O/c1-24-9-11-25(12-10-24)13-14-26-19-15-17(7-8-18(19)23-21(26)22)20(27)16-5-3-2-4-6-16/h2-8,15H,9-14H2,1H3,(H2,22,23) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388036
(CHEMBL2059169)Show SMILES O=C(CC1CCNCC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C21H22N4O2/c26-19(12-14-8-10-22-11-9-14)25-21-23-17-7-6-16(13-18(17)24-21)20(27)15-4-2-1-3-5-15/h1-7,13-14,22H,8-12H2,(H2,23,24,25,26) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388055
(CHEMBL2059358)Show InChI InChI=1S/C19H21N3O/c1-19(2,3)12-22-16-11-14(9-10-15(16)21-18(22)20)17(23)13-7-5-4-6-8-13/h4-11H,12H2,1-3H3,(H2,20,21) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388052
(CHEMBL2059355)Show SMILES Nc1nc2ccc(cc2n1CC[C@H]1CCCN1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H22N4O/c21-20-23-17-9-8-15(19(25)14-5-2-1-3-6-14)13-18(17)24(20)12-10-16-7-4-11-22-16/h1-3,5-6,8-9,13,16,22H,4,7,10-12H2,(H2,21,23)/t16-/m1/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 65 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388054
(CHEMBL2059357)Show InChI InChI=1S/C18H19N3O/c1-12(2)11-21-16-10-14(8-9-15(16)20-18(21)19)17(22)13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H2,19,20) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388051
(CHEMBL2059354)Show SMILES CN1CCC[C@H]1CCn1c(N)nc2ccc(cc12)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C21H24N4O/c1-24-12-5-8-17(24)11-13-25-19-14-16(9-10-18(19)23-21(25)22)20(26)15-6-3-2-4-7-15/h2-4,6-7,9-10,14,17H,5,8,11-13H2,1H3,(H2,22,23)/t17-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388034
(CHEMBL2059167)Show InChI InChI=1S/C18H18N4O2/c19-10-4-7-16(23)22-18-20-14-9-8-13(11-15(14)21-18)17(24)12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10,19H2,(H2,20,21,22,23) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 69 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388030
(CHEMBL170250 | US10544104, Compound 90)Show InChI InChI=1S/C17H16N4O3/c22-9-8-18-17(24)21-16-19-13-7-6-12(10-14(13)20-16)15(23)11-4-2-1-3-5-11/h1-7,10,22H,8-9H2,(H3,18,19,20,21,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 94 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388031
(CHEMBL2059164)Show SMILES O=C(NCCC1CCNCC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C22H25N5O2/c28-20(16-4-2-1-3-5-16)17-6-7-18-19(14-17)26-21(25-18)27-22(29)24-13-10-15-8-11-23-12-9-15/h1-7,14-15,23H,8-13H2,(H3,24,25,26,27,29) | 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 | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388032
(CHEMBL2059165 | US10544104, Compound 91)Show SMILES O=C(NCCC1CCCNC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C22H25N5O2/c28-20(16-6-2-1-3-7-16)17-8-9-18-19(13-17)26-21(25-18)27-22(29)24-12-10-15-5-4-11-23-14-15/h1-3,6-9,13,15,23H,4-5,10-12,14H2,(H3,24,25,26,27,29) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388053
(CHEMBL2059356)Show SMILES Nc1nc2ccc(cc2n1C[C@H]1CCNC1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H20N4O/c20-19-22-16-7-6-15(18(24)14-4-2-1-3-5-14)10-17(16)23(19)12-13-8-9-21-11-13/h1-7,10,13,21H,8-9,11-12H2,(H2,20,22)/t13-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388030
(CHEMBL170250 | US10544104, Compound 90)Show InChI InChI=1S/C17H16N4O3/c22-9-8-18-17(24)21-16-19-13-7-6-12(10-14(13)20-16)15(23)11-4-2-1-3-5-11/h1-7,10,22H,8-9H2,(H3,18,19,20,21,24) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388031
(CHEMBL2059164)Show SMILES O=C(NCCC1CCNCC1)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C22H25N5O2/c28-20(16-4-2-1-3-5-16)17-6-7-18-19(14-17)26-21(25-18)27-22(29)24-13-10-15-8-11-23-12-9-15/h1-7,14-15,23H,8-13H2,(H3,24,25,26,27,29) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388028
(CHEMBL2059162)Show SMILES NCCCCNC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C19H21N5O2/c20-10-4-5-11-21-19(26)24-18-22-15-9-8-14(12-16(15)23-18)17(25)13-6-2-1-3-7-13/h1-3,6-9,12H,4-5,10-11,20H2,(H3,21,22,23,24,26) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388045
(CHEMBL2059174)Show SMILES N[C@@H](Cc1cnc[nH]1)C(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H18N6O2/c21-15(9-14-10-22-11-23-14)19(28)26-20-24-16-7-6-13(8-17(16)25-20)18(27)12-4-2-1-3-5-12/h1-8,10-11,15H,9,21H2,(H,22,23)(H2,24,25,26,28)/t15-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388046
(CHEMBL2059175)Show SMILES CN1CCC(Cn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C21H24N4O/c1-24-11-9-15(10-12-24)14-25-19-13-17(7-8-18(19)23-21(25)22)20(26)16-5-3-2-4-6-16/h2-8,13,15H,9-12,14H2,1H3,(H2,22,23) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388043
(CHEMBL2059172)Show SMILES O=C(Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1)[C@@H]1CCCN1 |r| Show InChI InChI=1S/C19H18N4O2/c24-17(12-5-2-1-3-6-12)13-8-9-14-16(11-13)22-19(21-14)23-18(25)15-7-4-10-20-15/h1-3,5-6,8-9,11,15,20H,4,7,10H2,(H2,21,22,23,25)/t15-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388056
(CHEMBL2059359)Show InChI InChI=1S/C21H24N4O/c22-21-23-18-10-9-17(20(26)16-7-3-1-4-8-16)15-19(18)25(21)14-13-24-11-5-2-6-12-24/h1,3-4,7-10,15H,2,5-6,11-14H2,(H2,22,23) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388057
(CHEMBL2059362)Show SMILES CN1CCN(CCCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C22H27N5O/c1-25-12-14-26(15-13-25)10-5-11-27-20-16-18(8-9-19(20)24-22(27)23)21(28)17-6-3-2-4-7-17/h2-4,6-9,16H,5,10-15H2,1H3,(H2,23,24) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388033
(CHEMBL2059166 | US10544104, Compound 94 | US976503...)Show InChI InChI=1S/C17H16N4O2/c18-9-8-15(22)21-17-19-13-7-6-12(10-14(13)20-17)16(23)11-4-2-1-3-5-11/h1-7,10H,8-9,18H2,(H2,19,20,21,22) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388058
(CHEMBL2059363)Show InChI InChI=1S/C22H18FN3O/c23-18-9-6-15(7-10-18)12-13-26-20-14-17(8-11-19(20)25-22(26)24)21(27)16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H2,24,25) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388039
(CHEMBL2059360)Show InChI InChI=1S/C20H22N4O2/c21-20-22-17-7-6-16(19(25)15-4-2-1-3-5-15)14-18(17)24(20)9-8-23-10-12-26-13-11-23/h1-7,14H,8-13H2,(H2,21,22) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50383377
(CHEMBL2030560 | US10544104, Compound 92 | US976503...)Show InChI InChI=1S/C14H11N3O/c15-14-16-11-7-6-10(8-12(11)17-14)13(18)9-4-2-1-3-5-9/h1-8H,(H3,15,16,17) | PDB
UniProtKB/TrEMBL
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CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388059
(CHEMBL2059364)Show InChI InChI=1S/C21H18N4O/c22-21-24-18-10-9-16(20(26)15-6-2-1-3-7-15)14-19(18)25(21)13-11-17-8-4-5-12-23-17/h1-10,12,14H,11,13H2,(H2,22,24) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388029
(CHEMBL2059163)Show SMILES OCCCCNC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 Show InChI InChI=1S/C19H20N4O3/c24-11-5-4-10-20-19(26)23-18-21-15-9-8-14(12-16(15)22-18)17(25)13-6-2-1-3-7-13/h1-3,6-9,12,24H,4-5,10-11H2,(H3,20,21,22,23,26) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 380 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388049
(CHEMBL2059179)Show SMILES Nc1nc2ccc(cc2n1C[C@@H]1CCCN1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H20N4O/c20-19-22-16-9-8-14(18(24)13-5-2-1-3-6-13)11-17(16)23(19)12-15-7-4-10-21-15/h1-3,5-6,8-9,11,15,21H,4,7,10,12H2,(H2,20,22)/t15-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 410 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388044
(CHEMBL2059173)Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C23H20N4O3/c24-18(12-14-6-9-17(28)10-7-14)22(30)27-23-25-19-11-8-16(13-20(19)26-23)21(29)15-4-2-1-3-5-15/h1-11,13,18,28H,12,24H2,(H2,25,26,27,30)/t18-/m0/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 520 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388033
(CHEMBL2059166 | US10544104, Compound 94 | US976503...)Show InChI InChI=1S/C17H16N4O2/c18-9-8-15(22)21-17-19-13-7-6-12(10-14(13)20-17)16(23)11-4-2-1-3-5-11/h1-7,10H,8-9,18H2,(H2,19,20,21,22) | 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 | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388060
(CHEMBL2059365)Show SMILES NCCC(=O)Nc1nc2ccc(cc2n1CC1CCNCC1)C(=O)c1ccccc1 Show InChI InChI=1S/C23H27N5O2/c24-11-8-21(29)27-23-26-19-7-6-18(22(30)17-4-2-1-3-5-17)14-20(19)28(23)15-16-9-12-25-13-10-16/h1-7,14,16,25H,8-13,15,24H2,(H,26,27,29) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 570 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388050
(CHEMBL2059352)Show SMILES CN1CCC[C@@H]1Cn1c(N)nc2ccc(cc12)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H22N4O/c1-23-11-5-8-16(23)13-24-18-12-15(9-10-17(18)22-20(24)21)19(25)14-6-3-2-4-7-14/h2-4,6-7,9-10,12,16H,5,8,11,13H2,1H3,(H2,21,22)/t16-/m1/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50180753
((5-benzoyl-1H-benzimidazol-2-yl)-carbamic acid met...)Show InChI InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21) | PDB
UniProtKB/TrEMBL
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CHEMBL DrugBank MCE PC cid PC sid PDB UniChem
Patents
| Article PubMed
| n/a | n/a | 670 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388048
(CHEMBL2059178)Show SMILES Nc1nc2ccc(cc2n1C[C@H]1CCCN1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H20N4O/c20-19-22-16-9-8-14(18(24)13-5-2-1-3-6-13)11-17(16)23(19)12-15-7-4-10-21-15/h1-3,5-6,8-9,11,15,21H,4,7,10,12H2,(H2,20,22)/t15-/m1/s1 | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388027
(CHEMBL2059161)Show InChI InChI=1S/C21H24N4O/c26-20(16-6-2-1-3-7-16)17-8-9-18-19(13-17)25-21(24-18)23-12-10-15-5-4-11-22-14-15/h1-3,6-9,13,15,22H,4-5,10-12,14H2,(H2,23,24,25) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388026
(CHEMBL2059160)Show InChI InChI=1S/C16H15N3O2/c20-9-8-17-16-18-13-7-6-12(10-14(13)19-16)15(21)11-4-2-1-3-5-11/h1-7,10,20H,8-9H2,(H2,17,18,19) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Calmodulin-domain protein kinase 1
(Toxoplasma gondii) | BDBM50388025
(CHEMBL2059159)Show InChI InChI=1S/C16H15N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9,14,20H,1H3,(H2,17,18,19,21) | PDB
UniProtKB/TrEMBL
GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii CDPK1 |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50180753
((5-benzoyl-1H-benzimidazol-2-yl)-carbamic acid met...)Show InChI InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE PC cid PC sid PDB UniChem
Patents
| Article PubMed
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50388041
(CHEMBL2059353)Show SMILES Nc1nc2ccc(cc2n1CC[C@@H]1CCCN1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H22N4O/c21-20-23-17-9-8-15(19(25)14-5-2-1-3-6-14)13-18(17)24(20)12-10-16-7-4-11-22-16/h1-3,5-6,8-9,13,16,22H,4,7,10-12H2,(H2,21,23)/t16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388042
(CHEMBL2059361)Show SMILES CN1CCN(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C21H25N5O/c1-24-9-11-25(12-10-24)13-14-26-19-15-17(7-8-18(19)23-21(26)22)20(27)16-5-3-2-4-6-16/h2-8,15H,9-14H2,1H3,(H2,22,23) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50180753
((5-benzoyl-1H-benzimidazol-2-yl)-carbamic acid met...)Show InChI InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MCE PC cid PC sid PDB UniChem
Patents
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388041
(CHEMBL2059353)Show SMILES Nc1nc2ccc(cc2n1CC[C@@H]1CCCN1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H22N4O/c21-20-23-17-9-8-15(19(25)14-5-2-1-3-6-14)13-18(17)24(20)12-10-16-7-4-11-22-16/h1-3,5-6,8-9,13,16,22H,4,7,10-12H2,(H2,21,23)/t16-/m0/s1 | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388047
(CHEMBL2059176)Show InChI InChI=1S/C21H24N4O/c22-21-24-18-7-6-17(20(26)16-4-2-1-3-5-16)14-19(18)25(21)13-10-15-8-11-23-12-9-15/h1-7,14-15,23H,8-13H2,(H2,22,24) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50388033
(CHEMBL2059166 | US10544104, Compound 94 | US976503...)Show InChI InChI=1S/C17H16N4O2/c18-9-8-15(22)21-17-19-13-7-6-12(10-14(13)20-17)16(23)11-4-2-1-3-5-11/h1-7,10H,8-9,18H2,(H2,19,20,21,22) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50383377
(CHEMBL2030560 | US10544104, Compound 92 | US976503...)Show InChI InChI=1S/C14H11N3O/c15-14-16-11-7-6-10(8-12(11)17-14)13(18)9-4-2-1-3-5-9/h1-8H,(H3,15,16,17) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50388040
(CHEMBL2059177)Show SMILES CN1CCC(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C22H26N4O/c1-25-12-9-16(10-13-25)11-14-26-20-15-18(7-8-19(20)24-22(26)23)21(27)17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H2,23,24) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50388042
(CHEMBL2059361)Show SMILES CN1CCN(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C21H25N5O/c1-24-9-11-25(12-10-24)13-14-26-19-15-17(7-8-18(19)23-21(26)22)20(27)16-5-3-2-4-6-16/h2-8,15H,9-14H2,1H3,(H2,22,23) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50388047
(CHEMBL2059176)Show InChI InChI=1S/C21H24N4O/c22-21-24-18-7-6-17(20(26)16-4-2-1-3-5-16)14-19(18)25(21)13-10-15-8-11-23-12-9-15/h1-7,14-15,23H,8-13H2,(H2,22,24) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50388040
(CHEMBL2059177)Show SMILES CN1CCC(CCn2c(N)nc3ccc(cc23)C(=O)c2ccccc2)CC1 Show InChI InChI=1S/C22H26N4O/c1-25-12-9-16(10-13-25)11-14-26-20-15-18(7-8-19(20)24-22(26)23)21(27)17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H2,23,24) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50383378
(CHEMBL2030561)Show InChI InChI=1S/C20H22N4O/c21-20-23-17-7-6-16(19(25)15-4-2-1-3-5-15)12-18(17)24(20)13-14-8-10-22-11-9-14/h1-7,12,14,22H,8-11,13H2,(H2,21,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50383378
(CHEMBL2030561)Show InChI InChI=1S/C20H22N4O/c21-20-23-17-7-6-16(19(25)15-4-2-1-3-5-15)12-18(17)24(20)13-14-8-10-22-11-9-14/h1-7,12,14,22H,8-11,13H2,(H2,21,23) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50388060
(CHEMBL2059365)Show SMILES NCCC(=O)Nc1nc2ccc(cc2n1CC1CCNCC1)C(=O)c1ccccc1 Show InChI InChI=1S/C23H27N5O2/c24-11-8-21(29)27-23-26-19-7-6-18(22(30)17-4-2-1-3-5-17)14-20(19)28(23)15-16-9-12-25-13-10-16/h1-7,14,16,25H,8-13,15,24H2,(H,26,27,29) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human SRC |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50383377
(CHEMBL2030560 | US10544104, Compound 92 | US976503...)Show InChI InChI=1S/C14H11N3O/c15-14-16-11-7-6-10(8-12(11)17-14)13(18)9-4-2-1-3-5-9/h1-8H,(H3,15,16,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE 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 |
University of Washington
Curated by ChEMBL
| Assay Description Inhibition of human ABL |
Bioorg Med Chem Lett 22: 5264-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.050 BindingDB Entry DOI: 10.7270/Q2X63P0G |
More data for this Ligand-Target Pair | |