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BDBM50544975 CHEMBL4638092

SMILES: Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F

InChI Key: InChIKey=ZPPJQUHJUSSFKP-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50544975   
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
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50544975
PNG
(CHEMBL4638092)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C25H20F3N3O2/c1-16-8-9-18(10-23(16)33-22-6-4-3-5-7-22)24(32)30-20-11-19(25(26,27)28)12-21(13-20)31-14-17(2)29-15-31/h3-15H,1-2H3,(H,30,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 618n/an/an/an/an/an/a



Nyrada Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal GST-tagged c-Kit (544 to end residues) expressed in baculovirus infected Sf21 insect cells using FAM-label...


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair
Protein cereblon/Tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50544975
PNG
(CHEMBL4638092)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C25H20F3N3O2/c1-16-8-9-18(10-23(16)33-22-6-4-3-5-7-22)24(32)30-20-11-19(25(26,27)28)12-21(13-20)31-14-17(2)29-15-31/h3-15H,1-2H3,(H,30,32)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Nyrada Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full-length N-terminal GST-tagged SRC (1 to 536 residues) expressed in baculovirus expression system using FAM-labell...


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair
VHL/PDGFRB


(Homo sapiens (Human))
BDBM50544975
PNG
(CHEMBL4638092)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C25H20F3N3O2/c1-16-8-9-18(10-23(16)33-22-6-4-3-5-7-22)24(32)30-20-11-19(25(26,27)28)12-21(13-20)31-14-17(2)29-15-31/h3-15H,1-2H3,(H,30,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Nyrada Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system ...


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50544975
PNG
(CHEMBL4638092)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C25H20F3N3O2/c1-16-8-9-18(10-23(16)33-22-6-4-3-5-7-22)24(32)30-20-11-19(25(26,27)28)12-21(13-20)31-14-17(2)29-15-31/h3-15H,1-2H3,(H,30,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Nyrada Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His-tagged Abl (2 to 1130 residues) expressed in baculovirus expression system using FAM-labelled P2 pepti...


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair