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BDBM50384595 CHEMBL2036631

SMILES: CNc1ncc2c(nn(CC3CCC(N)CC3)c2n1)-c1cccc(OC)c1

InChI Key: InChIKey=JUQPSUXJSPFYGR-UHFFFAOYSA-N

Data: 3 IC50

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 3 hits for monomerid = 50384595   
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
AXL receptor tyrosine kinase


(Homo sapiens (Human))
BDBM50384595
PNG
(CHEMBL2036631)
Show SMILES CNc1ncc2c(nn(CC3CCC(N)CC3)c2n1)-c1cccc(OC)c1
Show InChI InChI=1S/C20H26N6O/c1-22-20-23-11-17-18(14-4-3-5-16(10-14)27-2)25-26(19(17)24-20)12-13-6-8-15(21)9-7-13/h3-5,10-11,13,15H,6-9,12,21H2,1-2H3,(H,22,23,24)
PDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Axl using KKKKEEIYFFF-CONH2 as substrate after 180 mins by microfluid capillary electrophoresis assay


ACS Med Chem Lett 3: 129-134 (2012)


Article DOI: 10.1021/ml200239k
BindingDB Entry DOI: 10.7270/Q2F76DMC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens)
BDBM50384595
PNG
(CHEMBL2036631)
Show SMILES CNc1ncc2c(nn(CC3CCC(N)CC3)c2n1)-c1cccc(OC)c1
Show InChI InChI=1S/C20H26N6O/c1-22-20-23-11-17-18(14-4-3-5-16(10-14)27-2)25-26(19(17)24-20)12-13-6-8-15(21)9-7-13/h3-5,10-11,13,15H,6-9,12,21H2,1-2H3,(H,22,23,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 120n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Mer expressed in Escherichia coli BL21 (DE3) cells using EFPIYDFLPAKKK-CONH2 as substrate after 180 mins by microfluid capillary electr...


ACS Med Chem Lett 3: 129-134 (2012)


Article DOI: 10.1021/ml200239k
BindingDB Entry DOI: 10.7270/Q2F76DMC
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor TYRO3


(Homo sapiens (Human))
BDBM50384595
PNG
(CHEMBL2036631)
Show SMILES CNc1ncc2c(nn(CC3CCC(N)CC3)c2n1)-c1cccc(OC)c1
Show InChI InChI=1S/C20H26N6O/c1-22-20-23-11-17-18(14-4-3-5-16(10-14)27-2)25-26(19(17)24-20)12-13-6-8-15(21)9-7-13/h3-5,10-11,13,15H,6-9,12,21H2,1-2H3,(H,22,23,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Tyro3 using EFPIYDFLPAKKK-CONH2 as substrate after 180 mins by microfluid capillary electrophoresis assay


ACS Med Chem Lett 3: 129-134 (2012)


Article DOI: 10.1021/ml200239k
BindingDB Entry DOI: 10.7270/Q2F76DMC
More data for this
Ligand-Target Pair