Found 2895 hits with Last Name = 'arnold' and Initial = 'ld' 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 Lck
(Homo sapiens (Human)) | BDBM50092233
(7-Isopropyl-5-(4-phenoxy-phenyl)-7H-pyrrolo[2,3-d]...)Show SMILES CC(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C21H20N4O/c1-14(2)25-12-18(19-20(22)23-13-24-21(19)25)15-8-10-17(11-9-15)26-16-6-4-3-5-7-16/h3-14H,1-2H3,(H2,22,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
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| PubMed
| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092228
(4-Amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrim...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1 Show InChI InChI=1S/C23H22N4O/c24-22-21-20(14-27(17-6-4-5-7-17)23(21)26-15-25-22)16-10-12-19(13-11-16)28-18-8-2-1-3-9-18/h1-3,8-15,17H,4-7H2,(H2,24,25,26) | PDB
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| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092224
(3-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCC(O)C1 Show InChI InChI=1S/C23H22N4O2/c24-22-21-20(13-27(23(21)26-14-25-22)16-8-9-17(28)12-16)15-6-10-19(11-7-15)29-18-4-2-1-3-5-18/h1-7,10-11,13-14,16-17,28H,8-9,12H2,(H2,24,25,26) | PDB
UniProtKB/SwissProt
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| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092232
(2-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1O Show InChI InChI=1S/C23H22N4O2/c24-22-21-18(13-27(23(21)26-14-25-22)19-7-4-8-20(19)28)15-9-11-17(12-10-15)29-16-5-2-1-3-6-16/h1-3,5-6,9-14,19-20,28H,4,7-8H2,(H2,24,25,26) | PDB
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| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092224
(3-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCC(O)C1 Show InChI InChI=1S/C23H22N4O2/c24-22-21-20(13-27(23(21)26-14-25-22)16-8-9-17(28)12-16)15-6-10-19(11-7-15)29-18-4-2-1-3-5-18/h1-7,10-11,13-14,16-17,28H,8-9,12H2,(H2,24,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
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| n/a | n/a | <1 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Gag-Pol polyprotein [489-587]
(Human immunodeficiency virus type 1) | BDBM50005701
(CHEMBL337283 | N*1*-[1-Benzyl-3-(2-tert-butylcarba...)Show SMILES CC(C)(C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1 Show InChI InChI=1S/C33H40N6O6/c1-33(2,3)38-31(44)26-14-9-17-39(26)32(45)28(41)24(18-20-10-5-4-6-11-20)36-30(43)25(19-27(34)40)37-29(42)23-16-15-21-12-7-8-13-22(21)35-23/h4-8,10-13,15-16,24-26,28,41H,9,14,17-19H2,1-3H3,(H2,34,40)(H,36,43)(H,37,42)(H,38,44)/t24-,25-,26-,28-/m0/s1 | PDB
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| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was evaluated for the inhibition of HIV protease |
Bioorg Med Chem Lett 6: 435-438 (1996)
Article DOI: 10.1016/0960-894X(96)00034-0
BindingDB Entry DOI: 10.7270/Q2W095X8 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092226
(4-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CC(O)C(O)C1 Show InChI InChI=1S/C23H22N4O3/c24-22-21-18(14-6-8-17(9-7-14)30-16-4-2-1-3-5-16)12-27(23(21)26-13-25-22)15-10-19(28)20(29)11-15/h1-9,12-13,15,19-20,28-29H,10-11H2,(H2,24,25,26) | PDB
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| CHEMBL
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| n/a | n/a | <2 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210309
(4-methyl-1-((3-(5-(3-phenoxyprop-1-ynyl)thiophen-3...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)C(=O)C1 Show InChI InChI=1S/C29H26N4O2S/c1-32-11-12-33(27(34)18-32)17-20-9-10-25-21(14-20)16-26-28(30-31-29(25)26)22-15-24(36-19-22)8-5-13-35-23-6-3-2-4-7-23/h2-4,6-7,9-10,14-15,19H,11-13,16-18H2,1H3,(H,30,31) | PDB
MMDB
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Reactome pathway
KEGG
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| CHEMBL
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PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1
(Homo sapiens (Human)) | BDBM50210272
(6-((4-methylpiperazin-1-yl)methyl)-3-(5-(3-phenoxy...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C29H28N4OS/c1-32-11-13-33(14-12-32)19-21-9-10-26-22(16-21)18-27-28(30-31-29(26)27)23-17-25(35-20-23)8-5-15-34-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,30,31) | PDB
MMDB
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Flt1 |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092228
(4-Amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrim...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1 Show InChI InChI=1S/C23H22N4O/c24-22-21-20(14-27(17-6-4-5-7-17)23(21)26-15-25-22)16-10-12-19(13-11-16)28-18-8-2-1-3-9-18/h1-3,8-15,17H,4-7H2,(H2,24,25,26) | PDB
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase catalytic domain at 1 mM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092225
(7-tert-Butyl-5-(4-phenoxy-phenyl)-7H-pyrrolo[2,3-d...)Show SMILES CC(C)(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C22H22N4O/c1-22(2,3)26-13-18(19-20(23)24-14-25-21(19)26)15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,23,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1
(Homo sapiens (Human)) | BDBM50210271
(7-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-5-4-16(12-28-15-24-14-25-28)9-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
MMDB
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Flt1 |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 3
(Homo sapiens (Human)) | BDBM50210272
(6-((4-methylpiperazin-1-yl)methyl)-3-(5-(3-phenoxy...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C29H28N4OS/c1-32-11-13-33(14-12-32)19-21-9-10-26-22(16-21)18-27-28(30-31-29(26)27)23-17-25(35-20-23)8-5-15-34-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,30,31) | PDB
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| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Flt4 |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210300
(CHEMBL225311 | N-(3-(4-(6-((4-methylpiperazin-1-yl...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCNC(=O)c3ccccc3)c2)CC1 Show InChI InChI=1S/C30H29N5OS/c1-34-12-14-35(15-13-34)19-21-9-10-26-23(16-21)18-27-28(32-33-29(26)27)24-17-25(37-20-24)8-5-11-31-30(36)22-6-3-2-4-7-22/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,31,36)(H,32,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein kinase FLT3
(Homo sapiens (Human)) | BDBM50210271
(7-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-5-4-16(12-28-15-24-14-25-28)9-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Flt3 |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 3
(Homo sapiens (Human)) | BDBM50210271
(7-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-5-4-16(12-28-15-24-14-25-28)9-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
KEGG
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PC cid
PC sid
UniChem
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PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Flt4 |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210299
(6-(2-(4-methylpiperazin-1-yl)ethyl)-3-(5-(3-phenox...)Show SMILES CN1CCN(CCc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C30H30N4OS/c1-33-13-15-34(16-14-33)12-11-22-9-10-27-23(18-22)20-28-29(31-32-30(27)28)24-19-26(36-21-24)8-5-17-35-25-6-3-2-4-7-25/h2-4,6-7,9-10,18-19,21H,11-17,20H2,1H3,(H,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092226
(4-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CC(O)C(O)C1 Show InChI InChI=1S/C23H22N4O3/c24-22-21-18(14-6-8-17(9-7-14)30-16-4-2-1-3-5-16)12-27(23(21)26-13-25-22)15-10-19(28)20(29)11-15/h1-9,12-13,15,19-20,28-29H,10-11H2,(H2,24,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092224
(3-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCC(O)C1 Show InChI InChI=1S/C23H22N4O2/c24-22-21-20(13-27(23(21)26-14-25-22)16-8-9-17(28)12-16)15-6-10-19(11-7-15)29-18-4-2-1-3-5-18/h1-7,10-11,13-14,16-17,28H,8-9,12H2,(H2,24,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 1 mM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210271
(7-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-5-4-16(12-28-15-24-14-25-28)9-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210300
(CHEMBL225311 | N-(3-(4-(6-((4-methylpiperazin-1-yl...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCNC(=O)c3ccccc3)c2)CC1 Show InChI InChI=1S/C30H29N5OS/c1-34-12-14-35(15-13-34)19-21-9-10-26-23(16-21)18-27-28(32-33-29(26)27)24-17-25(37-20-24)8-5-11-31-30(36)22-6-3-2-4-7-22/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,31,36)(H,32,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by ELISA |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210272
(6-((4-methylpiperazin-1-yl)methyl)-3-(5-(3-phenoxy...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C29H28N4OS/c1-32-11-13-33(14-12-32)19-21-9-10-26-22(16-21)18-27-28(30-31-29(26)27)23-17-25(35-20-23)8-5-15-34-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210309
(4-methyl-1-((3-(5-(3-phenoxyprop-1-ynyl)thiophen-3...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)C(=O)C1 Show InChI InChI=1S/C29H26N4O2S/c1-32-11-12-33(27(34)18-32)17-20-9-10-25-21(14-20)16-26-28(30-31-29(25)26)22-15-24(36-19-22)8-5-13-35-23-6-3-2-4-7-23/h2-4,6-7,9-10,14-15,19H,11-13,16-18H2,1H3,(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human KDR kinase by HTRF assay |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092232
(2-[4-Amino-5-(4-phenoxy-phenyl)-pyrrolo[2,3-d]pyri...)Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1O Show InChI InChI=1S/C23H22N4O2/c24-22-21-18(13-27(23(21)26-14-25-22)19-7-4-8-20(19)28)15-9-11-17(12-10-15)29-16-5-2-1-3-6-16/h1-3,5-6,9-14,19-20,28H,4,7-8H2,(H2,24,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | <8 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210277
(3-(5-(3-methoxyprop-1-ynyl)thiophen-3-yl)-6-((4-me...)Show SMILES COCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1cc(CN3CCN(C)CC3)ccc-21 Show InChI InChI=1S/C24H26N4OS/c1-27-7-9-28(10-8-27)15-17-5-6-21-18(12-17)14-22-23(25-26-24(21)22)19-13-20(30-16-19)4-3-11-29-2/h5-6,12-13,16H,7-11,14-15H2,1-2H3,(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Macrophage colony-stimulating factor 1 receptor
(Homo sapiens (Human)) | BDBM50210272
(6-((4-methylpiperazin-1-yl)methyl)-3-(5-(3-phenoxy...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C29H28N4OS/c1-32-11-13-33(14-12-32)19-21-9-10-26-22(16-21)18-27-28(30-31-29(26)27)23-17-25(35-20-23)8-5-15-34-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of CSF1R |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092231
((4-Phenoxy-phenyl)-quinazolin-4-yl-amine | CHEMBL3...)Show InChI InChI=1S/C20H15N3O/c1-2-6-16(7-3-1)24-17-12-10-15(11-13-17)23-20-18-8-4-5-9-19(18)21-14-22-20/h1-14H,(H,21,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | <8 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 1 mM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210269
(4-(4-(6-((4-methylpiperazin-1-yl)methyl)-1,4-dihyd...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCCO)c2)CC1 Show InChI InChI=1S/C24H26N4OS/c1-27-7-9-28(10-8-27)15-17-5-6-21-18(12-17)14-22-23(25-26-24(21)22)19-13-20(30-16-19)4-2-3-11-29/h5-6,12-13,16,29H,3,7-11,14-15H2,1H3,(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein kinase FLT3
(Homo sapiens (Human)) | BDBM50210272
(6-((4-methylpiperazin-1-yl)methyl)-3-(5-(3-phenoxy...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C29H28N4OS/c1-32-11-13-33(14-12-32)19-21-9-10-26-22(16-21)18-27-28(30-31-29(26)27)23-17-25(35-20-23)8-5-15-34-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,30,31) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of Flt3 |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210293
(4-((3-(5-(3-phenoxyprop-1-ynyl)thiophen-3-yl)-1,4-...)Show SMILES NC(=O)N1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C29H27N5O2S/c30-29(35)34-12-10-33(11-13-34)18-20-8-9-25-21(15-20)17-26-27(31-32-28(25)26)22-16-24(37-19-22)7-4-14-36-23-5-2-1-3-6-23/h1-3,5-6,8-9,15-16,19H,10-14,17-18H2,(H2,30,35)(H,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human KDR kinase by HTRF assay |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Macrophage colony-stimulating factor 1 receptor
(Homo sapiens (Human)) | BDBM50210271
(7-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-5-4-16(12-28-15-24-14-25-28)9-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of CSF1R |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210296
(3-(5-(3-(2-methoxyethoxy)prop-1-ynyl)thiophen-3-yl...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc2-c3ccc(CN4CCN(C)CC4)cc3C(=O)c12 Show InChI InChI=1S/C26H28N4O3S/c1-29-7-9-30(10-8-29)16-18-5-6-21-22(14-18)26(31)23-24(27-28-25(21)23)19-15-20(34-17-19)4-3-11-33-13-12-32-2/h5-6,14-15,17H,7-13,16H2,1-2H3,(H,27,28) | PDB
MMDB
NCI pathway
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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210284
(CHEMBL374690 | N,N-dimethyl-2-(3-(5-(3-phenoxyprop...)Show SMILES CN(C)C(=O)COc1ccc-2c(Cc3c-2n[nH]c3-c2csc(c2)C#CCOc2ccccc2)c1 Show InChI InChI=1S/C27H23N3O3S/c1-30(2)25(31)16-33-21-10-11-23-18(13-21)15-24-26(28-29-27(23)24)19-14-22(34-17-19)9-6-12-32-20-7-4-3-5-8-20/h3-5,7-8,10-11,13-14,17H,12,15-16H2,1-2H3,(H,28,29) | PDB
MMDB
NCI pathway
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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092233
(7-Isopropyl-5-(4-phenoxy-phenyl)-7H-pyrrolo[2,3-d]...)Show SMILES CC(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C21H20N4O/c1-14(2)25-12-18(19-20(22)23-13-24-21(19)25)15-8-10-17(11-9-15)26-16-6-4-3-5-7-16/h3-14H,1-2H3,(H2,22,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210316
(3-((3-(5-(3-phenoxyprop-1-ynyl)thiophen-3-yl)-1,4-...)Show SMILES C(Oc1ccccc1)C#Cc1cc(cs1)-c1[nH]nc-2c1Cc1cc(CN3CCSC3)ccc-21 Show InChI InChI=1S/C27H23N3OS2/c1-2-5-22(6-3-1)31-11-4-7-23-14-21(17-33-23)26-25-15-20-13-19(16-30-10-12-32-18-30)8-9-24(20)27(25)29-28-26/h1-3,5-6,8-9,13-14,17H,10-12,15-16,18H2,(H,28,29) | PDB
MMDB
NCI pathway
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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210306
(6-(4-methylpiperazin-1-yl)-3-(5-(3-phenoxyprop-1-y...)Show SMILES CN1CCN(CC1)c1ccc-2c(Cc3c-2n[nH]c3-c2csc(c2)C#CCOc2ccccc2)c1 Show InChI InChI=1S/C28H26N4OS/c1-31-11-13-32(14-12-31)22-9-10-25-20(16-22)18-26-27(29-30-28(25)26)21-17-24(34-19-21)8-5-15-33-23-6-3-2-4-7-23/h2-4,6-7,9-10,16-17,19H,11-15,18H2,1H3,(H,29,30) | PDB
MMDB
NCI pathway
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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50188749
(1-methyl-1-((5-(7-((4-methylpiperazin-1-yl)methyl)...)Show SMILES CN(Cc1ccc(s1)-c1[nH]nc-2c1Cc1ccc(CN3CCN(C)CC3)cc-21)C(=O)Nc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C30H31F3N6OS/c1-37-10-12-39(13-11-37)17-19-6-7-20-15-25-27(24(20)14-19)35-36-28(25)26-9-8-23(41-26)18-38(2)29(40)34-22-5-3-4-21(16-22)30(31,32)33/h3-9,14,16H,10-13,15,17-18H2,1-2H3,(H,34,40)(H,35,36) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of KDR at 1 mM ATP by HTRF assay |
Bioorg Med Chem Lett 16: 4266-71 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.066
BindingDB Entry DOI: 10.7270/Q2NP242Q |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210305
(1-(3-(4-(6-((4-methylpiperazin-1-yl)methyl)-1,4-di...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCNC(=O)Nc3ccccc3)c2)CC1 Show InChI InChI=1S/C30H30N6OS/c1-35-12-14-36(15-13-35)19-21-9-10-26-22(16-21)18-27-28(33-34-29(26)27)23-17-25(38-20-23)8-5-11-31-30(37)32-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,33,34)(H2,31,32,37) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human KDR kinase by HTRF assay |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210306
(6-(4-methylpiperazin-1-yl)-3-(5-(3-phenoxyprop-1-y...)Show SMILES CN1CCN(CC1)c1ccc-2c(Cc3c-2n[nH]c3-c2csc(c2)C#CCOc2ccccc2)c1 Show InChI InChI=1S/C28H26N4OS/c1-31-11-13-32(14-12-31)22-9-10-25-20(16-22)18-26-27(29-30-28(25)26)21-17-24(34-19-21)8-5-15-33-23-6-3-2-4-7-23/h2-4,6-7,9-10,16-17,19H,11-15,18H2,1H3,(H,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210285
(1-methyl-4-((3-(5-(3-phenoxyprop-1-ynyl)thiophen-3...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1=O Show InChI InChI=1S/C29H26N4O2S/c1-32-11-12-33(18-27(32)34)17-20-9-10-25-21(14-20)16-26-28(30-31-29(25)26)22-15-24(36-19-22)8-5-13-35-23-6-3-2-4-7-23/h2-4,6-7,9-10,14-15,19H,11-13,16-18H2,1H3,(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human KDR kinase by HTRF assay |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210314
(6-((1-methylpiperidin-4-yl)methyl)-3-(5-(3-phenoxy...)Show SMILES CN1CCC(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1 Show InChI InChI=1S/C30H29N3OS/c1-33-13-11-21(12-14-33)16-22-9-10-27-23(17-22)19-28-29(31-32-30(27)28)24-18-26(35-20-24)8-5-15-34-25-6-3-2-4-7-25/h2-4,6-7,9-10,17-18,20-21H,11-16,19H2,1H3,(H,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human KDR kinase by HTRF assay |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092233
(7-Isopropyl-5-(4-phenoxy-phenyl)-7H-pyrrolo[2,3-d]...)Show SMILES CC(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C21H20N4O/c1-14(2)25-12-18(19-20(22)23-13-24-21(19)25)15-8-10-17(11-9-15)26-16-6-4-3-5-7-16/h3-14H,1-2H3,(H2,22,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase at 1 mM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Mast/stem cell growth factor receptor Kit
(Homo sapiens (Human)) | BDBM50210271
(7-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-5-4-16(12-28-15-24-14-25-28)9-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of c-Kit |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50188753
(3-(3-chlorophenyl)-1-methyl-1-((5-(7-((4-methylpip...)Show SMILES CN(Cc1ccc(s1)-c1[nH]nc-2c1Cc1ccc(CN3CCN(C)CC3)cc-21)C(=O)Nc1cccc(Cl)c1 Show InChI InChI=1S/C29H31ClN6OS/c1-34-10-12-36(13-11-34)17-19-6-7-20-15-25-27(24(20)14-19)32-33-28(25)26-9-8-23(38-26)18-35(2)29(37)31-22-5-3-4-21(30)16-22/h3-9,14,16H,10-13,15,17-18H2,1-2H3,(H,31,37)(H,32,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of KDR at 1 mM ATP by HTRF assay |
Bioorg Med Chem Lett 16: 4266-71 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.066
BindingDB Entry DOI: 10.7270/Q2NP242Q |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210296
(3-(5-(3-(2-methoxyethoxy)prop-1-ynyl)thiophen-3-yl...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc2-c3ccc(CN4CCN(C)CC4)cc3C(=O)c12 Show InChI InChI=1S/C26H28N4O3S/c1-29-7-9-30(10-8-29)16-18-5-6-21-22(14-18)26(31)23-24(27-28-25(21)23)19-15-20(34-17-19)4-3-11-33-13-12-32-2/h5-6,14-15,17H,7-13,16H2,1-2H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human KDR |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Mast/stem cell growth factor receptor Kit
(Homo sapiens (Human)) | BDBM50188731
(1-((5-(6-((4-methylpiperazin-1-yl)methyl)-1,4-dihy...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3ccc(CNC(=O)Nc4ccc(cc4)C(F)(F)F)s3)c2)CC1 Show InChI InChI=1S/C29H29F3N6OS/c1-37-10-12-38(13-11-37)17-18-2-8-23-19(14-18)15-24-26(23)35-36-27(24)25-9-7-22(40-25)16-33-28(39)34-21-5-3-20(4-6-21)29(30,31)32/h2-9,14H,10-13,15-17H2,1H3,(H,35,36)(H2,33,34,39) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of cKit at 1 mM ATP by HTRF assay |
Bioorg Med Chem Lett 16: 4266-71 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.066
BindingDB Entry DOI: 10.7270/Q2NP242Q |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1
(Homo sapiens (Human)) | BDBM50188749
(1-methyl-1-((5-(7-((4-methylpiperazin-1-yl)methyl)...)Show SMILES CN(Cc1ccc(s1)-c1[nH]nc-2c1Cc1ccc(CN3CCN(C)CC3)cc-21)C(=O)Nc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C30H31F3N6OS/c1-37-10-12-39(13-11-37)17-19-6-7-20-15-25-27(24(20)14-19)35-36-28(25)26-9-8-23(41-26)18-38(2)29(40)34-22-5-3-4-21(16-22)30(31,32)33/h3-9,14,16H,10-13,15,17-18H2,1-2H3,(H,34,40)(H,35,36) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of FLT1 at 1mM ATP by HTRF assay |
Bioorg Med Chem Lett 16: 4266-71 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.066
BindingDB Entry DOI: 10.7270/Q2NP242Q |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210303
(6-((1H-1,2,4-triazol-1-yl)methyl)-3-(5-(3-(2-metho...)Show SMILES COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1cc(Cn3cncn3)ccc-21 Show InChI InChI=1S/C23H21N5O2S/c1-29-7-8-30-6-2-3-19-10-18(13-31-19)22-21-11-17-9-16(12-28-15-24-14-25-28)4-5-20(17)23(21)27-26-22/h4-5,9-10,13-15H,6-8,11-12H2,1H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by Western blot |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50092225
(7-tert-Butyl-5-(4-phenoxy-phenyl)-7H-pyrrolo[2,3-d...)Show SMILES CC(C)(C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C22H22N4O/c1-22(2,3)26-13-18(19-20(23)24-14-25-21(19)26)15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,23,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF Bioresearch Corporation
Curated by ChEMBL
| Assay Description
Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP |
Bioorg Med Chem Lett 10: 2167-70 (2001)
BindingDB Entry DOI: 10.7270/Q2J38RTH |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human)) | BDBM50210305
(1-(3-(4-(6-((4-methylpiperazin-1-yl)methyl)-1,4-di...)Show SMILES CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCNC(=O)Nc3ccccc3)c2)CC1 Show InChI InChI=1S/C30H30N6OS/c1-35-12-14-36(15-13-35)19-21-9-10-26-22(16-21)18-27-28(33-34-29(26)27)23-17-25(38-20-23)8-5-11-31-30(37)32-24-6-3-2-4-7-24/h2-4,6-7,9-10,16-17,20H,11-15,18-19H2,1H3,(H,33,34)(H2,31,32,37) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of VEGF-induced phosphorylation of human KDR expressed in mouse NIH3T3 cell line by ELISA |
J Med Chem 50: 2011-29 (2007)
Article DOI: 10.1021/jm061223o
BindingDB Entry DOI: 10.7270/Q2TB16K0 |
More data for this
Ligand-Target Pair | |
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