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SMILES: C(N1CCC[C@H](C1)n1nnc2cnc3[nH]ccc3c12)c1ccccc1

InChI Key: InChIKey=HGJNMNJIGZNLEP-OAHLLOKOSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50435506   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50435506
PNG
(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
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PC cid
PC sid
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Similars

Article
PubMed
25n/an/an/an/an/an/an/an/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))
BDBM50435506
PNG
(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
40n/an/an/an/an/an/an/an/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