Found 19 hits with Last Name = 'larroque' and Initial = 'al' 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)) | BDBM50215563
(4-(3,3-dimethyltriaz-1-en-1-yl)-N-(4-methyl-3-{[4-...)Show SMILES CN(C)N=Nc1ccc(cc1C(F)(F)F)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 Show InChI InChI=1S/C26H23F3N8O/c1-16-6-8-19(14-23(16)34-25-31-12-10-21(33-25)18-5-4-11-30-15-18)32-24(38)17-7-9-22(35-36-37(2)3)20(13-17)26(27,28)29/h4-15H,1-3H3,(H,32,38)(H,31,33,34) | 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 | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215565
(CHEMBL230065 | N-(4-methyl-3-{[4-(pyridin-3-yl)pyr...)Show SMILES CN=NNc1ccc(cc1C(F)(F)F)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 |w:1.0| Show InChI InChI=1S/C25H21F3N8O/c1-15-5-7-18(13-22(15)34-24-31-11-9-20(33-24)17-4-3-10-30-14-17)32-23(37)16-6-8-21(35-36-29-2)19(12-16)25(26,27)28/h3-14H,1-2H3,(H,29,35)(H,32,37)(H,31,33,34) | 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 | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215562
(4-[3-(hydroxymethyl)-3-methyltriaz-1-en-1-yl]-N-(4...)Show SMILES CN(CO)N=Nc1ccc(cc1C(F)(F)F)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 Show InChI InChI=1S/C26H23F3N8O2/c1-16-5-7-19(13-23(16)34-25-31-11-9-21(33-25)18-4-3-10-30-14-18)32-24(39)17-6-8-22(35-36-37(2)15-38)20(12-17)26(27,28)29/h3-14,38H,15H2,1-2H3,(H,32,39)(H,31,33,34) | 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 | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM13530
(4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[...)Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1 Show InChI InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM3294
(4-Anilinoquinazoline deriv. 45 | 4-N-(3-bromopheny...)Show InChI InChI=1S/C14H11BrN4/c15-9-2-1-3-11(6-9)19-14-12-7-10(16)4-5-13(12)17-8-18-14/h1-8H,16H2,(H,17,18,19) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | 37 |
McGill University/Royal Victoria Hospital
| Assay Description
EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional. |
Chem Biol Drug Des 71: 374-9 (2008)
Article DOI: 10.1111/j.1747-0285.2008.00638.x
BindingDB Entry DOI: 10.7270/Q29P303S |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM81727
(Bis-quinazolinotriazene, 5b)Show SMILES CN(CCN(CCN(C)\N=N\c1ccc2ncnc(Nc3cccc(Br)c3)c2c1)CCN1CCOCC1)\N=N\c1ccc2ncnc(Nc3cccc(Br)c3)c2c1 Show InChI InChI=1S/C40H44Br2N14O/c1-53(51-49-33-9-11-37-35(25-33)39(45-27-43-37)47-31-7-3-5-29(41)23-31)13-15-55(17-18-56-19-21-57-22-20-56)16-14-54(2)52-50-34-10-12-38-36(26-34)40(46-28-44-38)48-32-8-4-6-30(42)24-32/h3-12,23-28H,13-22H2,1-2H3,(H,43,45,47)(H,44,46,48)/b51-49+,52-50+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
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antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | 37 |
McGill University/Royal Victoria Hospital
| Assay Description
EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional. |
Chem Biol Drug Des 71: 374-9 (2008)
Article DOI: 10.1111/j.1747-0285.2008.00638.x
BindingDB Entry DOI: 10.7270/Q29P303S |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM81728
(Bis-quinazolinotriazene, 5c)Show SMILES CN(CCN(CCN(C)\N=N\c1ccc2ncnc(Nc3cccc(Cl)c3)c2c1)CCN1CCOCC1)\N=N\c1ccc2ncnc(Nc3cccc(Cl)c3)c2c1 Show InChI InChI=1S/C40H44Cl2N14O/c1-53(51-49-33-9-11-37-35(25-33)39(45-27-43-37)47-31-7-3-5-29(41)23-31)13-15-55(17-18-56-19-21-57-22-20-56)16-14-54(2)52-50-34-10-12-38-36(26-34)40(46-28-44-38)48-32-8-4-6-30(42)24-32/h3-12,23-28H,13-22H2,1-2H3,(H,43,45,47)(H,44,46,48)/b51-49+,52-50+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | 37 |
McGill University/Royal Victoria Hospital
| Assay Description
EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional. |
Chem Biol Drug Des 71: 374-9 (2008)
Article DOI: 10.1111/j.1747-0285.2008.00638.x
BindingDB Entry DOI: 10.7270/Q29P303S |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215557
(4-amino-N-(4-methyl-3-(4-(pyridin-3-yl)pyrimidin-2...)Show SMILES Cc1ccc(NC(=O)c2ccc(N)c(c2)C(F)(F)F)cc1Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C24H19F3N6O/c1-14-4-6-17(31-22(34)15-5-7-19(28)18(11-15)24(25,26)27)12-21(14)33-23-30-10-8-20(32-23)16-3-2-9-29-13-16/h2-13H,28H2,1H3,(H,31,34)(H,30,32,33) | 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 | 156 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215561
(3-chloro-N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin...)Show SMILES CN=NNc1ccc(cc1Cl)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 |w:1.0| Show InChI InChI=1S/C24H21ClN8O/c1-15-5-7-18(29-23(34)16-6-8-21(19(25)12-16)32-33-26-2)13-22(15)31-24-28-11-9-20(30-24)17-4-3-10-27-14-17/h3-14H,1-2H3,(H,26,32)(H,29,34)(H,28,30,31) | 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 | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50133382
(Anilinoquinazoline, 4c | CHEMBL343352 | N*4*-(3-Ch...)Show InChI InChI=1S/C14H11ClN4/c15-9-2-1-3-11(6-9)19-14-12-7-10(16)4-5-13(12)17-8-18-14/h1-8H,16H2,(H,17,18,19) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | 37 |
McGill University/Royal Victoria Hospital
| Assay Description
EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional. |
Chem Biol Drug Des 71: 374-9 (2008)
Article DOI: 10.1111/j.1747-0285.2008.00638.x
BindingDB Entry DOI: 10.7270/Q29P303S |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215558
(4-(bis(2-chloroethyl)amino)-N-(4-methyl-3-(4-(pyri...)Show SMILES Cc1ccc(NC(=O)c2ccc(cc2)N(CCCl)CCCl)cc1Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C27H26Cl2N6O/c1-19-4-7-22(32-26(36)20-5-8-23(9-6-20)35(15-11-28)16-12-29)17-25(19)34-27-31-14-10-24(33-27)21-3-2-13-30-18-21/h2-10,13-14,17-18H,11-12,15-16H2,1H3,(H,32,36)(H,31,33,34) | 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 | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50307929
(CHEMBL591897 | N-(2-((2-(3-(4-(3-chlorophenylamino...)Show SMILES CN(CCNS(=O)(=O)c1cccc2c(cccc12)N(C)C)CCN=NNc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1 |w:23.24| Show InChI InChI=1S/C31H34ClN9O2S/c1-40(2)29-11-5-10-26-25(29)9-6-12-30(26)44(42,43)36-16-18-41(3)17-15-35-39-38-24-13-14-28-27(20-24)31(34-21-33-28)37-23-8-4-7-22(32)19-23/h4-14,19-21,36H,15-18H2,1-3H3,(H,35,38)(H,33,34,37) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University Health Center/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of EGFR |
J Med Chem 53: 2104-13 (2010)
Article DOI: 10.1021/jm9016043
BindingDB Entry DOI: 10.7270/Q2BV7GQ6 |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM81726
(Bis-quinazolinotriazene, 5a)Show SMILES CN(CCN(CCN(C)\N=N\c1ccc2ncnc(Nc3cccc(C)c3)c2c1)CCN1CCOCC1)\N=N\c1ccc2ncnc(Nc3cccc(C)c3)c2c1 Show InChI InChI=1S/C42H50N14O/c1-31-7-5-9-33(25-31)47-41-37-27-35(11-13-39(37)43-29-45-41)49-51-53(3)15-17-55(19-20-56-21-23-57-24-22-56)18-16-54(4)52-50-36-12-14-40-38(28-36)42(46-30-44-40)48-34-10-6-8-32(2)26-34/h5-14,25-30H,15-24H2,1-4H3,(H,43,45,47)(H,44,46,48)/b51-49+,52-50+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 950 | n/a | n/a | n/a | n/a | n/a | 37 |
McGill University/Royal Victoria Hospital
| Assay Description
EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional. |
Chem Biol Drug Des 71: 374-9 (2008)
Article DOI: 10.1111/j.1747-0285.2008.00638.x
BindingDB Entry DOI: 10.7270/Q29P303S |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50133384
(Anilinoquinazoline, 4a | CHEMBL336113 | N*4*-m-Tol...)Show InChI InChI=1S/C15H14N4/c1-10-3-2-4-12(7-10)19-15-13-8-11(16)5-6-14(13)17-9-18-15/h2-9H,16H2,1H3,(H,17,18,19) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | 37 |
McGill University/Royal Victoria Hospital
| Assay Description
EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional. |
Chem Biol Drug Des 71: 374-9 (2008)
Article DOI: 10.1111/j.1747-0285.2008.00638.x
BindingDB Entry DOI: 10.7270/Q29P303S |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215559
(4-(3,methylhydroxy3-methyltriaz-1-ene)-N-[4-methyl...)Show SMILES CN(CO)N=Nc1ccc(cc1)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 Show InChI InChI=1S/C25H24N8O2/c1-17-5-8-21(28-24(35)18-6-9-20(10-7-18)31-32-33(2)16-34)14-23(17)30-25-27-13-11-22(29-25)19-4-3-12-26-15-19/h3-15,34H,16H2,1-2H3,(H,28,35)(H,27,29,30) | 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 | 1.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50307930
(CHEMBL606413 | N-(2-(3-(4-(3-chlorophenylamino)qui...)Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCN=NNc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1 |w:19.20| Show InChI InChI=1S/C28H27ClN8O2S/c1-37(2)26-10-4-9-23-22(26)8-5-11-27(23)40(38,39)33-15-14-32-36-35-21-12-13-25-24(17-21)28(31-18-30-25)34-20-7-3-6-19(29)16-20/h3-13,16-18,33H,14-15H2,1-2H3,(H,32,35)(H,30,31,34) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University Health Center/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of EGFR |
J Med Chem 53: 2104-13 (2010)
Article DOI: 10.1021/jm9016043
BindingDB Entry DOI: 10.7270/Q2BV7GQ6 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215564
(4-(((2-chloroethyl)(methyl)amino)methyl)-N-(4-meth...)Show SMILES CN(CCCl)Cc1ccc(cc1)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 Show InChI InChI=1S/C27H27ClN6O/c1-19-5-10-23(31-26(35)21-8-6-20(7-9-21)18-34(2)15-12-28)16-25(19)33-27-30-14-11-24(32-27)22-4-3-13-29-17-22/h3-11,13-14,16-17H,12,15,18H2,1-2H3,(H,31,35)(H,30,32,33) | 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 | 3.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50132709
(4-Amino-N-[4-methyl-3-(4-pyridin-3-yl-pyrimidin-2-...)Show SMILES Cc1ccc(NC(=O)c2ccc(N)cc2)cc1Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C23H20N6O/c1-15-4-9-19(27-22(30)16-5-7-18(24)8-6-16)13-21(15)29-23-26-12-10-20(28-23)17-3-2-11-25-14-17/h2-14H,24H2,1H3,(H,27,30)(H,26,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50215560
(4-((bis(2-chloroethyl)amino)methyl)-N-(4-methyl-3-...)Show SMILES Cc1ccc(NC(=O)c2ccc(CN(CCCl)CCCl)cc2)cc1Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C28H28Cl2N6O/c1-20-4-9-24(17-26(20)35-28-32-14-10-25(34-28)23-3-2-13-31-18-23)33-27(37)22-7-5-21(6-8-22)19-36(15-11-29)16-12-30/h2-10,13-14,17-18H,11-12,15-16,19H2,1H3,(H,33,37)(H,32,34,35) | 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 |
McGill University/Royal Victoria Hospital
Curated by ChEMBL
| Assay Description
Inhibition of c-Abl |
Bioorg Med Chem Lett 17: 4248-53 (2007)
Article DOI: 10.1016/j.bmcl.2007.05.067
BindingDB Entry DOI: 10.7270/Q29K49XM |
More data for this
Ligand-Target Pair | |
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