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BDBM50201167 CHEMBL3973561

SMILES: CN1CCN(Cc2ccc(cc2)-c2cn3CCC[C@H](N)C(=O)NCCCCNc4ncc2c3n4)CC1

InChI Key: InChIKey=UVBALELUPGCHKQ-DEOSSOPVSA-N

Data: 4 IC50  1 EC50

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 5 hits for monomerid = 50201167   
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
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50201167
PNG
(CHEMBL3973561)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cn3CCC[C@H](N)C(=O)NCCCCNc4ncc2c3n4)CC1 |r|
Show InChI InChI=1S/C27H38N8O/c1-33-13-15-34(16-14-33)18-20-6-8-21(9-7-20)23-19-35-12-4-5-24(28)26(36)29-10-2-3-11-30-27-31-17-22(23)25(35)32-27/h6-9,17,19,24H,2-5,10-16,18,28H2,1H3,(H,29,36)(H,30,31,32)/t24-/m0/s1
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Article
PubMed
n/an/a 20n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of Flt3 (unknown origin) by microfluidic capillary electrophoresis assay


ACS Med Chem Lett 7: 1044-1049 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00221
BindingDB Entry DOI: 10.7270/Q208679K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Mer


(Homo sapiens (Human))
BDBM50201167
PNG
(CHEMBL3973561)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cn3CCC[C@H](N)C(=O)NCCCCNc4ncc2c3n4)CC1 |r|
Show InChI InChI=1S/C27H38N8O/c1-33-13-15-34(16-14-33)18-20-6-8-21(9-7-20)23-19-35-12-4-5-24(28)26(36)29-10-2-3-11-30-27-31-17-22(23)25(35)32-27/h6-9,17,19,24H,2-5,10-16,18,28H2,1H3,(H,29,36)(H,30,31,32)/t24-/m0/s1
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n/an/an/an/a>1.00E+3n/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of human MerTK kinase domain (1585 to 3000 residues) expressed in HEK293 cells co-expressing rat EGFR LBD assessed as inhibition of EGF-st...


ACS Med Chem Lett 7: 1044-1049 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00221
BindingDB Entry DOI: 10.7270/Q208679K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor TYRO3


(Homo sapiens (Human))
BDBM50201167
PNG
(CHEMBL3973561)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cn3CCC[C@H](N)C(=O)NCCCCNc4ncc2c3n4)CC1 |r|
Show InChI InChI=1S/C27H38N8O/c1-33-13-15-34(16-14-33)18-20-6-8-21(9-7-20)23-19-35-12-4-5-24(28)26(36)29-10-2-3-11-30-27-31-17-22(23)25(35)32-27/h6-9,17,19,24H,2-5,10-16,18,28H2,1H3,(H,29,36)(H,30,31,32)/t24-/m0/s1
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Article
PubMed
n/an/a 39n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of Tyro3 (unknown origin) by microfluidic capillary electrophoresis assay


ACS Med Chem Lett 7: 1044-1049 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00221
BindingDB Entry DOI: 10.7270/Q208679K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Mer


(Homo sapiens (Human))
BDBM50201167
PNG
(CHEMBL3973561)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cn3CCC[C@H](N)C(=O)NCCCCNc4ncc2c3n4)CC1 |r|
Show InChI InChI=1S/C27H38N8O/c1-33-13-15-34(16-14-33)18-20-6-8-21(9-7-20)23-19-35-12-4-5-24(28)26(36)29-10-2-3-11-30-27-31-17-22(23)25(35)32-27/h6-9,17,19,24H,2-5,10-16,18,28H2,1H3,(H,29,36)(H,30,31,32)/t24-/m0/s1
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n/an/a 3.90n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of MerTK (unknown origin) by microfluidic capillary electrophoresis assay


ACS Med Chem Lett 7: 1044-1049 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00221
BindingDB Entry DOI: 10.7270/Q208679K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor UFO


(Homo sapiens (Human))
BDBM50201167
PNG
(CHEMBL3973561)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cn3CCC[C@H](N)C(=O)NCCCCNc4ncc2c3n4)CC1 |r|
Show InChI InChI=1S/C27H38N8O/c1-33-13-15-34(16-14-33)18-20-6-8-21(9-7-20)23-19-35-12-4-5-24(28)26(36)29-10-2-3-11-30-27-31-17-22(23)25(35)32-27/h6-9,17,19,24H,2-5,10-16,18,28H2,1H3,(H,29,36)(H,30,31,32)/t24-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 33n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of Axl (unknown origin) by microfluidic capillary electrophoresis assay


ACS Med Chem Lett 7: 1044-1049 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00221
BindingDB Entry DOI: 10.7270/Q208679K
More data for this
Ligand-Target Pair