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BDBM50509518 CHEMBL4483465

SMILES: Cc1ccc(cc1NCc1cncc(c1)-c1ccc[nH]1)C(=O)Nc1ccc(C)c(c1)C(F)(F)F

InChI Key: InChIKey=DTAKXSCGKBXZTR-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50509518   
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
Discoidin domain-containing receptor 2


(Homo sapiens (Human))
BDBM50509518
PNG
(CHEMBL4483465)
Show SMILES Cc1ccc(cc1NCc1cncc(c1)-c1ccc[nH]1)C(=O)Nc1ccc(C)c(c1)C(F)(F)F
Show InChI InChI=1S/C26H23F3N4O/c1-16-6-8-21(12-22(16)26(27,28)29)33-25(34)19-7-5-17(2)24(11-19)32-14-18-10-20(15-30-13-18)23-4-3-9-31-23/h3-13,15,31-32H,14H2,1-2H3,(H,33,34)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 44n/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Inhibition of kinase tracer 178 binding to recombinant human His-tagged DDR2 expressed in baculovirus infected Sf9 cells incubated for 1 hr by TR-FRE...


ACS Med Chem Lett 11: 29-33 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00382
More data for this
Ligand-Target Pair
Epithelial discoidin domain-containing receptor 1


(Homo sapiens (Human))
BDBM50509518
PNG
(CHEMBL4483465)
Show SMILES Cc1ccc(cc1NCc1cncc(c1)-c1ccc[nH]1)C(=O)Nc1ccc(C)c(c1)C(F)(F)F
Show InChI InChI=1S/C26H23F3N4O/c1-16-6-8-21(12-22(16)26(27,28)29)33-25(34)19-7-5-17(2)24(11-19)32-14-18-10-20(15-30-13-18)23-4-3-9-31-23/h3-13,15,31-32H,14H2,1-2H3,(H,33,34)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 36n/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Inhibition of kinase tracer 178 binding to recombinant human His-tagged DDR1 expressed in baculovirus infected Sf9 cells incubated for 1 hr by TR-FRE...


ACS Med Chem Lett 11: 29-33 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00382
More data for this
Ligand-Target Pair