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SMILES: COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3nc(nc3c2C(N)=O)-c2ccccc2)cc(OC)c1

InChI Key: InChIKey=QMTFEPLRHYDWQT-UXHICEINSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50263119   
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 ZAP-70


(Homo sapiens (Human))
BDBM50263119
PNG
(CHEMBL478642 | cis-5-(2-Aminocyclohexylamino)-7-(3...)
Show SMILES COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3nc(nc3c2C(N)=O)-c2ccccc2)cc(OC)c1 |r|
Show InChI InChI=1S/C26H30N8O3/c1-36-17-12-16(13-18(14-17)37-2)29-24-21(22(28)35)25-31-23(15-8-4-3-5-9-15)33-34(25)26(32-24)30-20-11-7-6-10-19(20)27/h3-5,8-9,12-14,19-20,29H,6-7,10-11,27H2,1-2H3,(H2,28,35)(H,30,32)/t19-,20+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Kissei Pharmaceutical Company Ltd

Curated by ChEMBL


Assay Description
Inhibition of human ZAP70


Bioorg Med Chem 16: 7347-57 (2008)


Article DOI: 10.1016/j.bmc.2008.06.017
BindingDB Entry DOI: 10.7270/Q2HQ3ZP6
More data for this
Ligand-Target Pair
Lysine--tRNA ligase


(Homo sapiens (Human))
BDBM50263119
PNG
(CHEMBL478642 | cis-5-(2-Aminocyclohexylamino)-7-(3...)
Show SMILES COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3nc(nc3c2C(N)=O)-c2ccccc2)cc(OC)c1 |r|
Show InChI InChI=1S/C26H30N8O3/c1-36-17-12-16(13-18(14-17)37-2)29-24-21(22(28)35)25-31-23(15-8-4-3-5-9-15)33-34(25)26(32-24)30-20-11-7-6-10-19(20)27/h3-5,8-9,12-14,19-20,29H,6-7,10-11,27H2,1-2H3,(H2,28,35)(H,30,32)/t19-,20+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 83n/an/an/an/an/an/a



Kissei Pharmaceutical Company Ltd

Curated by ChEMBL


Assay Description
Inhibition of human Syk


Bioorg Med Chem 16: 7347-57 (2008)


Article DOI: 10.1016/j.bmc.2008.06.017
BindingDB Entry DOI: 10.7270/Q2HQ3ZP6
More data for this
Ligand-Target Pair