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BDBM324607 2-[4-[[8-[8-(3- fluoroazetidine-1- carbonyl)-3,8- diazabicyclo[3.2.1]octan- 3-yl]-[1,2,4]triazolo[1,5-a] pyridin-2- yl]amino]pyrazol-1-yl]-1- (4-methylpiperazin-1- yl)ethanone::US10189836, Example 170

SMILES: CN1CCN(CC1)C(=O)Cn1cc(Nc2nc3c(cccn3n2)N2CC3CCC(C2)N3C(=O)N2CC(F)C2)cn1

InChI Key: InChIKey=VKERTUOBZIKJDO-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 324607   
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 JAK2


(Homo sapiens (Human))
BDBM324607
PNG
(2-[4-[[8-[8-(3- fluoroazetidine-1- carbonyl)-3,8- ...)
Show SMILES CN1CCN(CC1)C(=O)Cn1cc(Nc2nc3c(cccn3n2)N2CC3CCC(C2)N3C(=O)N2CC(F)C2)cn1
Show InChI InChI=1S/C26H34FN11O2/c1-32-7-9-33(10-8-32)23(39)17-36-14-19(11-28-36)29-25-30-24-22(3-2-6-37(24)31-25)34-15-20-4-5-21(16-34)38(20)26(40)35-12-18(27)13-35/h2-3,6,11,14,18,20-21H,4-5,7-10,12-13,15-17H2,1H3,(H,29,31)
PDB

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UniProtKB/SwissProt

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DrugBank
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PC cid
PC sid
UniChem
US Patent
0.200n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...


US Patent US10189836 (2019)


BindingDB Entry DOI: 10.7270/Q2G162XH
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM324607
PNG
(2-[4-[[8-[8-(3- fluoroazetidine-1- carbonyl)-3,8- ...)
Show SMILES CN1CCN(CC1)C(=O)Cn1cc(Nc2nc3c(cccn3n2)N2CC3CCC(C2)N3C(=O)N2CC(F)C2)cn1
Show InChI InChI=1S/C26H34FN11O2/c1-32-7-9-33(10-8-32)23(39)17-36-14-19(11-28-36)29-25-30-24-22(3-2-6-37(24)31-25)34-15-20-4-5-21(16-34)38(20)26(40)35-12-18(27)13-35/h2-3,6,11,14,18,20-21H,4-5,7-10,12-13,15-17H2,1H3,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
0.300n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...


US Patent US10189836 (2019)


BindingDB Entry DOI: 10.7270/Q2G162XH
More data for this
Ligand-Target Pair