Found 62 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 JAK1
(Homo sapiens (Human)) | BDBM50391996
(CHEMBL2152300)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1cnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C16H16N6O/c17-5-3-14(23)21-7-1-2-11(9-21)22-10-20-13-8-19-16-12(15(13)22)4-6-18-16/h4,6,8,10-11H,1-3,7,9H2,(H,18,19)/t11-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| 0.400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50391996
(CHEMBL2152300)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1cnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C16H16N6O/c17-5-3-14(23)21-7-1-2-11(9-21)22-10-20-13-8-19-16-12(15(13)22)4-6-18-16/h4,6,8,10-11H,1-3,7,9H2,(H,18,19)/t11-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435526
(CHEMBL2392500)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C15H15N7O/c16-5-3-13(23)21-7-1-2-10(9-21)22-14-11-4-6-17-15(11)18-8-12(14)19-20-22/h4,6,8,10H,1-3,7,9H2,(H,17,18)/t10-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
| PDB
Article
PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435523
(CHEMBL2392488)Show InChI InChI=1S/C15H17N7/c16-5-1-7-21-8-3-11(4-9-21)22-14-12-2-6-17-15(12)18-10-13(14)19-20-22/h2,6,10-11H,1,3-4,7-9H2,(H,17,18) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435524
(CHEMBL2392485)Show SMILES CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C17H22N6O2/c1-17(2,3)25-16(24)20-10-4-5-11(8-10)23-14-12-6-7-18-15(12)19-9-13(14)21-22-23/h6-7,9-11H,4-5,8H2,1-3H3,(H,18,19)(H,20,24)/t10-,11-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435523
(CHEMBL2392488)Show InChI InChI=1S/C15H17N7/c16-5-1-7-21-8-3-11(4-9-21)22-14-12-2-6-17-15(12)18-10-13(14)19-20-22/h2,6,10-11H,1,3-4,7-9H2,(H,17,18) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435526
(CHEMBL2392500)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C15H15N7O/c16-5-3-13(23)21-7-1-2-10(9-21)22-14-11-4-6-17-15(11)18-8-12(14)19-20-22/h4,6,8,10H,1-3,7,9H2,(H,17,18)/t10-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
| Article
PubMed
| 3.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435520
(CHEMBL2392484)Show SMILES CC(C)CC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:7.6,wD:10.13,(69.03,-37.07,;68.99,-35.53,;70.3,-34.73,;67.64,-34.8,;66.32,-35.6,;66.37,-37.14,;64.97,-34.87,;63.66,-35.67,;63.7,-37.21,;62.39,-38.02,;61.04,-37.28,;60.99,-35.75,;62.3,-34.94,;59.73,-38.09,;58.21,-37.94,;57.6,-39.34,;58.74,-40.36,;58.74,-41.9,;60.07,-42.67,;61.41,-41.89,;62.88,-42.36,;63.78,-41.11,;62.87,-39.87,;61.4,-40.35,;60.06,-39.58,)| Show InChI InChI=1S/C18H24N6O/c1-11(2)9-16(25)21-12-3-5-13(6-4-12)24-17-14-7-8-19-18(14)20-10-15(17)22-23-24/h7-8,10-13H,3-6,9H2,1-2H3,(H,19,20)(H,21,25)/t12-,13- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435522
(CHEMBL2392480)Show SMILES N#CCCN[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(11.59,-36.36,;10.24,-35.63,;8.89,-34.9,;7.58,-35.71,;6.22,-34.97,;4.91,-35.78,;4.95,-37.32,;3.65,-38.12,;2.29,-37.39,;2.24,-35.85,;3.56,-35.04,;.99,-38.19,;-.54,-38.04,;-1.15,-39.44,;-.01,-40.46,;-.01,-42,;1.33,-42.77,;2.67,-41.99,;4.14,-42.46,;5.04,-41.21,;4.12,-39.97,;2.66,-40.45,;1.32,-39.68,)| Show InChI InChI=1S/C16H19N7/c17-7-1-8-18-11-2-4-12(5-3-11)23-15-13-6-9-19-16(13)20-10-14(15)21-22-23/h6,9-12,18H,1-5,8H2,(H,19,20)/t11-,12- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435521
(CHEMBL2392489)Show InChI InChI=1S/C13H16N6O2S/c1-22(20,21)18-6-3-9(4-7-18)19-12-10-2-5-14-13(10)15-8-11(12)16-17-19/h2,5,8-9H,3-4,6-7H2,1H3,(H,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435519
(CHEMBL2392493)Show SMILES CC1(CCN(CC1)S(C)(=O)=O)n1nnc2cnc3[nH]ccc3c12 Show InChI InChI=1S/C14H18N6O2S/c1-14(4-7-19(8-5-14)23(2,21)22)20-12-10-3-6-15-13(10)16-9-11(12)17-18-20/h3,6,9H,4-5,7-8H2,1-2H3,(H,15,16) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435525
(CHEMBL2392487)Show InChI InChI=1S/C19H20N6/c1-2-4-14(5-3-1)13-24-10-7-15(8-11-24)25-18-16-6-9-20-19(16)21-12-17(18)22-23-25/h1-6,9,12,15H,7-8,10-11,13H2,(H,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435524
(CHEMBL2392485)Show SMILES CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C17H22N6O2/c1-17(2,3)25-16(24)20-10-4-5-11(8-10)23-14-12-6-7-18-15(12)19-9-13(14)21-22-23/h6-7,9-11H,4-5,8H2,1-3H3,(H,18,19)(H,20,24)/t10-,11-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435512
(CHEMBL2392499)Show SMILES O[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:1.0,wD:4.7,(64.38,-23.09,;63.07,-23.89,;63.11,-25.43,;61.81,-26.23,;60.45,-25.5,;60.4,-23.97,;61.72,-23.16,;59.15,-26.3,;57.63,-26.15,;57.01,-27.56,;58.16,-28.57,;58.16,-30.11,;59.49,-30.88,;60.83,-30.11,;62.3,-30.57,;63.2,-29.32,;62.28,-28.08,;60.82,-28.56,;59.48,-27.8,)| Show InChI InChI=1S/C13H15N5O/c19-9-3-1-8(2-4-9)18-12-10-5-6-14-13(10)15-7-11(12)16-17-18/h5-9,19H,1-4H2,(H,14,15)/t8-,9- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435521
(CHEMBL2392489)Show InChI InChI=1S/C13H16N6O2S/c1-22(20,21)18-6-3-9(4-7-18)19-12-10-2-5-14-13(10)15-8-11(12)16-17-19/h2,5,8-9H,3-4,6-7H2,1H3,(H,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435518
(CHEMBL2392486)Show SMILES COC(=O)N[C@@H]1CC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C14H16N6O2/c1-22-14(21)17-8-2-3-9(6-8)20-12-10-4-5-15-13(10)16-7-11(12)18-19-20/h4-5,7-9H,2-3,6H2,1H3,(H,15,16)(H,17,21)/t8-,9-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435515
(CHEMBL2392483)Show SMILES COC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(54.14,-36.54,;52.78,-35.81,;51.47,-36.61,;51.51,-38.15,;50.12,-35.88,;48.81,-36.69,;48.85,-38.22,;47.55,-39.03,;46.19,-38.29,;46.14,-36.76,;47.46,-35.95,;44.88,-39.1,;43.36,-38.95,;42.75,-40.35,;43.9,-41.37,;43.89,-42.91,;45.23,-43.68,;46.57,-42.9,;48.03,-43.37,;48.93,-42.12,;48.02,-40.87,;46.56,-41.36,;45.22,-40.59,)| Show InChI InChI=1S/C15H18N6O2/c1-23-15(22)18-9-2-4-10(5-3-9)21-13-11-6-7-16-14(11)17-8-12(13)19-20-21/h6-10H,2-5H2,1H3,(H,16,17)(H,18,22)/t9-,10- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435525
(CHEMBL2392487)Show InChI InChI=1S/C19H20N6/c1-2-4-14(5-3-1)13-24-10-7-15(8-11-24)25-18-16-6-9-20-19(16)21-12-17(18)22-23-25/h1-6,9,12,15H,7-8,10-11,13H2,(H,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435516
(CHEMBL2392490)Show InChI InChI=1S/C18H19N7/c1-2-13(10-19-6-1)12-24-8-4-14(5-9-24)25-17-15-3-7-20-18(15)21-11-16(17)22-23-25/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435520
(CHEMBL2392484)Show SMILES CC(C)CC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:7.6,wD:10.13,(69.03,-37.07,;68.99,-35.53,;70.3,-34.73,;67.64,-34.8,;66.32,-35.6,;66.37,-37.14,;64.97,-34.87,;63.66,-35.67,;63.7,-37.21,;62.39,-38.02,;61.04,-37.28,;60.99,-35.75,;62.3,-34.94,;59.73,-38.09,;58.21,-37.94,;57.6,-39.34,;58.74,-40.36,;58.74,-41.9,;60.07,-42.67,;61.41,-41.89,;62.88,-42.36,;63.78,-41.11,;62.87,-39.87,;61.4,-40.35,;60.06,-39.58,)| Show InChI InChI=1S/C18H24N6O/c1-11(2)9-16(25)21-12-3-5-13(6-4-12)24-17-14-7-8-19-18(14)20-10-15(17)22-23-24/h7-8,10-13H,3-6,9H2,1-2H3,(H,19,20)(H,21,25)/t12-,13- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435522
(CHEMBL2392480)Show SMILES N#CCCN[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(11.59,-36.36,;10.24,-35.63,;8.89,-34.9,;7.58,-35.71,;6.22,-34.97,;4.91,-35.78,;4.95,-37.32,;3.65,-38.12,;2.29,-37.39,;2.24,-35.85,;3.56,-35.04,;.99,-38.19,;-.54,-38.04,;-1.15,-39.44,;-.01,-40.46,;-.01,-42,;1.33,-42.77,;2.67,-41.99,;4.14,-42.46,;5.04,-41.21,;4.12,-39.97,;2.66,-40.45,;1.32,-39.68,)| Show InChI InChI=1S/C16H19N7/c17-7-1-8-18-11-2-4-12(5-3-11)23-15-13-6-9-19-16(13)20-10-14(15)21-22-23/h6,9-12,18H,1-5,8H2,(H,19,20)/t11-,12- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435509
(CHEMBL2392498)Show SMILES N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:1.0,wD:4.7,(52.74,-23.67,;51.43,-24.47,;51.46,-26.01,;50.16,-26.81,;48.81,-26.08,;48.75,-24.55,;50.07,-23.74,;47.5,-26.88,;45.98,-26.74,;45.37,-28.14,;46.51,-29.15,;46.51,-30.7,;47.84,-31.46,;49.18,-30.69,;50.65,-31.15,;51.55,-29.9,;50.63,-28.66,;49.17,-29.15,;47.83,-28.38,)| Show InChI InChI=1S/C13H16N6/c14-8-1-3-9(4-2-8)19-12-10-5-6-15-13(10)16-7-11(12)17-18-19/h5-9H,1-4,14H2,(H,15,16)/t8-,9- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435527
(CHEMBL2392497)Show SMILES F[C@@H]1CNCC[C@H]1n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C12H13FN6/c13-8-5-14-3-2-10(8)19-11-7-1-4-15-12(7)16-6-9(11)17-18-19/h1,4,6,8,10,14H,2-3,5H2,(H,15,16)/t8-,10-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK3
(Homo sapiens (Human)) | BDBM50435526
(CHEMBL2392500)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C15H15N7O/c16-5-3-13(23)21-7-1-2-10(9-21)22-14-11-4-6-17-15(11)18-8-12(14)19-20-22/h4,6,8,10H,1-3,7,9H2,(H,17,18)/t10-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
| Article
PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK3 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435506
(CHEMBL2392501)Show SMILES C(N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12)c1ccccc1 |r| Show InChI InChI=1S/C19H20N6/c1-2-5-14(6-3-1)12-24-10-4-7-15(13-24)25-18-16-8-9-20-19(16)21-11-17(18)22-23-25/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,20,21)/t15-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435515
(CHEMBL2392483)Show SMILES COC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(54.14,-36.54,;52.78,-35.81,;51.47,-36.61,;51.51,-38.15,;50.12,-35.88,;48.81,-36.69,;48.85,-38.22,;47.55,-39.03,;46.19,-38.29,;46.14,-36.76,;47.46,-35.95,;44.88,-39.1,;43.36,-38.95,;42.75,-40.35,;43.9,-41.37,;43.89,-42.91,;45.23,-43.68,;46.57,-42.9,;48.03,-43.37,;48.93,-42.12,;48.02,-40.87,;46.56,-41.36,;45.22,-40.59,)| Show InChI InChI=1S/C15H18N6O2/c1-23-15(22)18-9-2-4-10(5-3-9)21-13-11-6-7-16-14(11)17-8-12(13)19-20-21/h6-10H,2-5H2,1H3,(H,16,17)(H,18,22)/t9-,10- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435516
(CHEMBL2392490)Show InChI InChI=1S/C18H19N7/c1-2-13(10-19-6-1)12-24-8-4-14(5-9-24)25-17-15-3-7-20-18(15)21-11-16(17)22-23-25/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H,20,21) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435512
(CHEMBL2392499)Show SMILES O[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:1.0,wD:4.7,(64.38,-23.09,;63.07,-23.89,;63.11,-25.43,;61.81,-26.23,;60.45,-25.5,;60.4,-23.97,;61.72,-23.16,;59.15,-26.3,;57.63,-26.15,;57.01,-27.56,;58.16,-28.57,;58.16,-30.11,;59.49,-30.88,;60.83,-30.11,;62.3,-30.57,;63.2,-29.32,;62.28,-28.08,;60.82,-28.56,;59.48,-27.8,)| Show InChI InChI=1S/C13H15N5O/c19-9-3-1-8(2-4-9)18-12-10-5-6-14-13(10)15-7-11(12)16-17-18/h5-9,19H,1-4H2,(H,14,15)/t8-,9- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 32 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435518
(CHEMBL2392486)Show SMILES COC(=O)N[C@@H]1CC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C14H16N6O2/c1-22-14(21)17-8-2-3-9(6-8)20-12-10-4-5-15-13(10)16-7-11(12)18-19-20/h4-5,7-9H,2-3,6H2,1H3,(H,15,16)(H,17,21)/t8-,9-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 33 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435506
(CHEMBL2392501)Show SMILES C(N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12)c1ccccc1 |r| Show InChI InChI=1S/C19H20N6/c1-2-5-14(6-3-1)12-24-10-4-7-15(13-24)25-18-16-8-9-20-19(16)21-11-17(18)22-23-25/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,20,21)/t15-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435519
(CHEMBL2392493)Show SMILES CC1(CCN(CC1)S(C)(=O)=O)n1nnc2cnc3[nH]ccc3c12 Show InChI InChI=1S/C14H18N6O2S/c1-14(4-7-19(8-5-14)23(2,21)22)20-12-10-3-6-15-13(10)16-9-11(12)17-18-20/h3,6,9H,4-5,7-8H2,1-2H3,(H,15,16) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435527
(CHEMBL2392497)Show SMILES F[C@@H]1CNCC[C@H]1n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C12H13FN6/c13-8-5-14-3-2-10(8)19-11-7-1-4-15-12(7)16-6-9(11)17-18-19/h1,4,6,8,10,14H,2-3,5H2,(H,15,16)/t8-,10-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 57 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435517
(CHEMBL2392482)Show SMILES CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:8.7,wD:11.14,(38.37,-38.93,;38.33,-37.4,;39.64,-36.59,;39.65,-38.16,;36.97,-36.66,;35.66,-37.47,;35.7,-39.01,;34.31,-36.73,;33,-37.54,;33.04,-39.08,;31.73,-39.88,;30.37,-39.15,;30.32,-37.61,;31.64,-36.8,;29.07,-39.95,;27.55,-39.8,;26.93,-41.21,;28.08,-42.22,;28.08,-43.77,;29.41,-44.54,;30.75,-43.76,;32.22,-44.23,;33.12,-42.97,;32.2,-41.73,;30.74,-42.22,;29.4,-41.45,)| Show InChI InChI=1S/C18H24N6O2/c1-18(2,3)26-17(25)21-11-4-6-12(7-5-11)24-15-13-8-9-19-16(13)20-10-14(15)22-23-24/h8-12H,4-7H2,1-3H3,(H,19,20)(H,21,25)/t11-,12- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435510
(CHEMBL2392491)Show SMILES CN1CCC[C@H]1C(=O)N1CCC(CC1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C18H23N7O/c1-23-8-2-3-15(23)18(26)24-9-5-12(6-10-24)25-16-13-4-7-19-17(13)20-11-14(16)21-22-25/h4,7,11-12,15H,2-3,5-6,8-10H2,1H3,(H,19,20)/t15-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 121 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435509
(CHEMBL2392498)Show SMILES N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:1.0,wD:4.7,(52.74,-23.67,;51.43,-24.47,;51.46,-26.01,;50.16,-26.81,;48.81,-26.08,;48.75,-24.55,;50.07,-23.74,;47.5,-26.88,;45.98,-26.74,;45.37,-28.14,;46.51,-29.15,;46.51,-30.7,;47.84,-31.46,;49.18,-30.69,;50.65,-31.15,;51.55,-29.9,;50.63,-28.66,;49.17,-29.15,;47.83,-28.38,)| Show InChI InChI=1S/C13H16N6/c14-8-1-3-9(4-2-8)19-12-10-5-6-15-13(10)16-7-11(12)17-18-19/h5-9H,1-4,14H2,(H,15,16)/t8-,9- | PDB
Reactome pathway
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PC sid
UniChem
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| Article
PubMed
| 121 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK3
(Homo sapiens (Human)) | BDBM50435522
(CHEMBL2392480)Show SMILES N#CCCN[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(11.59,-36.36,;10.24,-35.63,;8.89,-34.9,;7.58,-35.71,;6.22,-34.97,;4.91,-35.78,;4.95,-37.32,;3.65,-38.12,;2.29,-37.39,;2.24,-35.85,;3.56,-35.04,;.99,-38.19,;-.54,-38.04,;-1.15,-39.44,;-.01,-40.46,;-.01,-42,;1.33,-42.77,;2.67,-41.99,;4.14,-42.46,;5.04,-41.21,;4.12,-39.97,;2.66,-40.45,;1.32,-39.68,)| Show InChI InChI=1S/C16H19N7/c17-7-1-8-18-11-2-4-12(5-3-11)23-15-13-6-9-19-16(13)20-10-14(15)21-22-23/h6,9-12,18H,1-5,8H2,(H,19,20)/t11-,12- | PDB
Reactome pathway
KEGG
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PC sid
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| Article
PubMed
| 122 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK3 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435513
(CHEMBL2392492)Show InChI InChI=1S/C16H19N7/c1-16(4-9-22(10-5-16)8-2-6-17)23-14-12-3-7-18-15(12)19-11-13(14)20-21-23/h3,7,11H,2,4-5,8-10H2,1H3,(H,18,19) | PDB
Reactome pathway
KEGG
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PC cid
PC sid
UniChem
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| Article
PubMed
| 156 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435514
(CHEMBL2392496)Show InChI InChI=1S/C12H13FN6/c13-8-5-14-3-2-10(8)19-11-7-1-4-15-12(7)16-6-9(11)17-18-19/h1,4,6,8,10,14H,2-3,5H2,(H,15,16)/t8-,10+/m0/s1 | PDB
Reactome pathway
KEGG
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PC sid
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| Article
PubMed
| 198 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435511
(CHEMBL2392494)Show InChI InChI=1S/C12H14N6/c1-4-13-5-2-8(1)18-11-9-3-6-14-12(9)15-7-10(11)16-17-18/h3,6-8,13H,1-2,4-5H2,(H,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK3
(Homo sapiens (Human)) | BDBM50435519
(CHEMBL2392493)Show SMILES CC1(CCN(CC1)S(C)(=O)=O)n1nnc2cnc3[nH]ccc3c12 Show InChI InChI=1S/C14H18N6O2S/c1-14(4-7-19(8-5-14)23(2,21)22)20-12-10-3-6-15-13(10)16-9-11(12)17-18-20/h3,6,9H,4-5,7-8H2,1-2H3,(H,15,16) | PDB
Reactome pathway
KEGG
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PC sid
UniChem
Similars
| Article
PubMed
| 369 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK3 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435517
(CHEMBL2392482)Show SMILES CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:8.7,wD:11.14,(38.37,-38.93,;38.33,-37.4,;39.64,-36.59,;39.65,-38.16,;36.97,-36.66,;35.66,-37.47,;35.7,-39.01,;34.31,-36.73,;33,-37.54,;33.04,-39.08,;31.73,-39.88,;30.37,-39.15,;30.32,-37.61,;31.64,-36.8,;29.07,-39.95,;27.55,-39.8,;26.93,-41.21,;28.08,-42.22,;28.08,-43.77,;29.41,-44.54,;30.75,-43.76,;32.22,-44.23,;33.12,-42.97,;32.2,-41.73,;30.74,-42.22,;29.4,-41.45,)| Show InChI InChI=1S/C18H24N6O2/c1-18(2,3)26-17(25)21-11-4-6-12(7-5-11)24-15-13-8-9-19-16(13)20-10-14(15)22-23-24/h8-12H,4-7H2,1-3H3,(H,19,20)(H,21,25)/t11-,12- | PDB
Reactome pathway
KEGG
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| 401 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435514
(CHEMBL2392496)Show InChI InChI=1S/C12H13FN6/c13-8-5-14-3-2-10(8)19-11-7-1-4-15-12(7)16-6-9(11)17-18-19/h1,4,6,8,10,14H,2-3,5H2,(H,15,16)/t8-,10+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 446 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435513
(CHEMBL2392492)Show InChI InChI=1S/C16H19N7/c1-16(4-9-22(10-5-16)8-2-6-17)23-14-12-3-7-18-15(12)19-11-13(14)20-21-23/h3,7,11H,2,4-5,8-10H2,1H3,(H,18,19) | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| 487 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435511
(CHEMBL2392494)Show InChI InChI=1S/C12H14N6/c1-4-13-5-2-8(1)18-11-9-3-6-14-12(9)15-7-10(11)16-17-18/h3,6-8,13H,1-2,4-5H2,(H,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 669 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435510
(CHEMBL2392491)Show SMILES CN1CCC[C@H]1C(=O)N1CCC(CC1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C18H23N7O/c1-23-8-2-3-15(23)18(26)24-9-5-12(6-10-24)25-16-13-4-7-19-17(13)20-11-14(16)21-22-25/h4,7,11-12,15H,2-3,5-6,8-10H2,1H3,(H,19,20)/t15-/m0/s1 | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 721 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435508
(CHEMBL2392495)Show InChI InChI=1S/C13H16N6/c1-4-14-5-2-9(1)8-19-12-10-3-6-15-13(10)16-7-11(12)17-18-19/h3,6-7,9,14H,1-2,4-5,8H2,(H,15,16) | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| 745 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50435508
(CHEMBL2392495)Show InChI InChI=1S/C13H16N6/c1-4-14-5-2-9(1)8-19-12-10-3-6-15-13(10)16-7-11(12)17-18-19/h3,6-7,9,14H,1-2,4-5,8H2,(H,15,16) | PDB
Reactome pathway
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PubMed
| 1.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435507
(CHEMBL2392481)Show SMILES N#CCCO[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(24.44,-37.17,;23.09,-36.44,;21.74,-35.71,;20.43,-36.51,;19.08,-35.78,;17.77,-36.58,;17.81,-38.12,;16.5,-38.93,;15.15,-38.19,;15.1,-36.66,;16.41,-35.85,;13.84,-39,;12.32,-38.85,;11.71,-40.25,;12.85,-41.27,;12.85,-42.81,;14.18,-43.58,;15.52,-42.8,;16.99,-43.27,;17.89,-42.01,;16.98,-40.77,;15.51,-41.26,;14.17,-40.49,)| Show InChI InChI=1S/C16H18N6O/c17-7-1-9-23-12-4-2-11(3-5-12)22-15-13-6-8-18-16(13)19-10-14(15)20-21-22/h6,8,10-12H,1-5,9H2,(H,18,19)/t11-,12- | PDB
Reactome pathway
KEGG
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GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >3.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1 (unknown origin) |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435522
(CHEMBL2392480)Show SMILES N#CCCN[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(11.59,-36.36,;10.24,-35.63,;8.89,-34.9,;7.58,-35.71,;6.22,-34.97,;4.91,-35.78,;4.95,-37.32,;3.65,-38.12,;2.29,-37.39,;2.24,-35.85,;3.56,-35.04,;.99,-38.19,;-.54,-38.04,;-1.15,-39.44,;-.01,-40.46,;-.01,-42,;1.33,-42.77,;2.67,-41.99,;4.14,-42.46,;5.04,-41.21,;4.12,-39.97,;2.66,-40.45,;1.32,-39.68,)| Show InChI InChI=1S/C16H19N7/c17-7-1-8-18-11-2-4-12(5-3-11)23-15-13-6-9-19-16(13)20-10-14(15)21-22-23/h6,9-12,18H,1-5,8H2,(H,19,20)/t11-,12- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 165 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435509
(CHEMBL2392498)Show SMILES N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:1.0,wD:4.7,(52.74,-23.67,;51.43,-24.47,;51.46,-26.01,;50.16,-26.81,;48.81,-26.08,;48.75,-24.55,;50.07,-23.74,;47.5,-26.88,;45.98,-26.74,;45.37,-28.14,;46.51,-29.15,;46.51,-30.7,;47.84,-31.46,;49.18,-30.69,;50.65,-31.15,;51.55,-29.9,;50.63,-28.66,;49.17,-29.15,;47.83,-28.38,)| Show InChI InChI=1S/C13H16N6/c14-8-1-3-9(4-2-8)19-12-10-5-6-15-13(10)16-7-11(12)17-18-19/h5-9H,1-4,14H2,(H,15,16)/t8-,9- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 729 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435523
(CHEMBL2392488)Show InChI InChI=1S/C15H17N7/c16-5-1-7-21-8-3-11(4-9-21)22-14-12-2-6-17-15(12)18-10-13(14)19-20-22/h2,6,10-11H,1,3-4,7-9H2,(H,17,18) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 138 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435515
(CHEMBL2392483)Show SMILES COC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:5.4,wD:8.11,(54.14,-36.54,;52.78,-35.81,;51.47,-36.61,;51.51,-38.15,;50.12,-35.88,;48.81,-36.69,;48.85,-38.22,;47.55,-39.03,;46.19,-38.29,;46.14,-36.76,;47.46,-35.95,;44.88,-39.1,;43.36,-38.95,;42.75,-40.35,;43.9,-41.37,;43.89,-42.91,;45.23,-43.68,;46.57,-42.9,;48.03,-43.37,;48.93,-42.12,;48.02,-40.87,;46.56,-41.36,;45.22,-40.59,)| Show InChI InChI=1S/C15H18N6O2/c1-23-15(22)18-9-2-4-10(5-3-9)21-13-11-6-7-16-14(11)17-8-12(13)19-20-21/h6-10H,2-5H2,1H3,(H,16,17)(H,18,22)/t9-,10- | PDB
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Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435518
(CHEMBL2392486)Show SMILES COC(=O)N[C@@H]1CC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C14H16N6O2/c1-22-14(21)17-8-2-3-9(6-8)20-12-10-4-5-15-13(10)16-7-11(12)18-19-20/h4-5,7-9H,2-3,6H2,1H3,(H,15,16)(H,17,21)/t8-,9-/m1/s1 | PDB
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Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435519
(CHEMBL2392493)Show SMILES CC1(CCN(CC1)S(C)(=O)=O)n1nnc2cnc3[nH]ccc3c12 Show InChI InChI=1S/C14H18N6O2S/c1-14(4-7-19(8-5-14)23(2,21)22)20-12-10-3-6-15-13(10)16-9-11(12)17-18-20/h3,6,9H,4-5,7-8H2,1-2H3,(H,15,16) | PDB
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Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50391996
(CHEMBL2152300)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1cnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C16H16N6O/c17-5-3-14(23)21-7-1-2-11(9-21)22-10-20-13-8-19-16-12(15(13)22)4-6-18-16/h4,6,8,10-11H,1-3,7,9H2,(H,18,19)/t11-/m1/s1 | PDB
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| n/a | n/a | n/a | n/a | 180 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435512
(CHEMBL2392499)Show SMILES O[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:1.0,wD:4.7,(64.38,-23.09,;63.07,-23.89,;63.11,-25.43,;61.81,-26.23,;60.45,-25.5,;60.4,-23.97,;61.72,-23.16,;59.15,-26.3,;57.63,-26.15,;57.01,-27.56,;58.16,-28.57,;58.16,-30.11,;59.49,-30.88,;60.83,-30.11,;62.3,-30.57,;63.2,-29.32,;62.28,-28.08,;60.82,-28.56,;59.48,-27.8,)| Show InChI InChI=1S/C13H15N5O/c19-9-3-1-8(2-4-9)18-12-10-5-6-14-13(10)15-7-11(12)16-17-18/h5-9,19H,1-4H2,(H,14,15)/t8-,9- | PDB
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| n/a | n/a | n/a | n/a | 558 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435516
(CHEMBL2392490)Show InChI InChI=1S/C18H19N7/c1-2-13(10-19-6-1)12-24-8-4-14(5-9-24)25-17-15-3-7-20-18(15)21-11-16(17)22-23-25/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H,20,21) | PDB
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| n/a | n/a | n/a | n/a | 414 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435524
(CHEMBL2392485)Show SMILES CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C17H22N6O2/c1-17(2,3)25-16(24)20-10-4-5-11(8-10)23-14-12-6-7-18-15(12)19-9-13(14)21-22-23/h6-7,9-11H,4-5,8H2,1-3H3,(H,18,19)(H,20,24)/t10-,11-/m1/s1 | PDB
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Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435521
(CHEMBL2392489)Show InChI InChI=1S/C13H16N6O2S/c1-22(20,21)18-6-3-9(4-7-18)19-12-10-2-5-14-13(10)15-8-11(12)16-17-19/h2,5,8-9H,3-4,6-7H2,1H3,(H,14,15) | PDB
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| n/a | n/a | n/a | n/a | 249 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435526
(CHEMBL2392500)Show SMILES O=C(CC#N)N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C15H15N7O/c16-5-3-13(23)21-7-1-2-10(9-21)22-14-11-4-6-17-15(11)18-8-12(14)19-20-22/h4,6,8,10H,1-3,7,9H2,(H,17,18)/t10-/m1/s1 | PDB
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| PDB
Article
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| n/a | n/a | n/a | n/a | 114 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435520
(CHEMBL2392484)Show SMILES CC(C)CC(=O)N[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12 |r,wU:7.6,wD:10.13,(69.03,-37.07,;68.99,-35.53,;70.3,-34.73,;67.64,-34.8,;66.32,-35.6,;66.37,-37.14,;64.97,-34.87,;63.66,-35.67,;63.7,-37.21,;62.39,-38.02,;61.04,-37.28,;60.99,-35.75,;62.3,-34.94,;59.73,-38.09,;58.21,-37.94,;57.6,-39.34,;58.74,-40.36,;58.74,-41.9,;60.07,-42.67,;61.41,-41.89,;62.88,-42.36,;63.78,-41.11,;62.87,-39.87,;61.4,-40.35,;60.06,-39.58,)| Show InChI InChI=1S/C18H24N6O/c1-11(2)9-16(25)21-12-3-5-13(6-4-12)24-17-14-7-8-19-18(14)20-10-15(17)22-23-24/h7-8,10-13H,3-6,9H2,1-2H3,(H,19,20)(H,21,25)/t12-,13- | PDB
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| n/a | n/a | n/a | n/a | 350 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK1
(Homo sapiens (Human)) | BDBM50435525
(CHEMBL2392487)Show InChI InChI=1S/C19H20N6/c1-2-4-14(5-3-1)13-24-10-7-15(8-11-24)25-18-16-6-9-20-19(16)21-12-17(18)22-23-25/h1-6,9,12,15H,7-8,10-11,13H2,(H,20,21) | PDB
Reactome pathway
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| n/a | n/a | n/a | n/a | 121 | n/a | n/a | n/a | n/a |
Argenta Discovery Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of JAK1-mediated STAT3 phosphorylation in IL6-induced human TF1 cells |
Bioorg Med Chem Lett 23: 3592-8 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.018
BindingDB Entry DOI: 10.7270/Q2GH9KB2 |
More data for this
Ligand-Target Pair | |
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