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BDBM16099 3-carbamoyl-5-(4-phenylphenyl)benzoic acid::5-carbamoyl-1,1 :4 ,1 -terphenyl-3-carboxylic acid::AMX02::Brequinar-derived asymmetric terphenyl compound

SMILES: NC(=O)c1cc(cc(c1)-c1ccc(cc1)-c1ccccc1)C(O)=O

InChI Key: InChIKey=LAZPCGBRHLARSI-UHFFFAOYSA-N

Data: 1 KI

PDB links: 1 PDB ID matches this monomer.

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 1 hit for monomerid = 16099   
Target
(Institution)
LigandTarget
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
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM16099
PNG
(3-carbamoyl-5-(4-phenylphenyl)benzoic acid | 5-car...)
Show SMILES NC(=O)c1cc(cc(c1)-c1ccc(cc1)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C20H15NO3/c21-19(22)17-10-16(11-18(12-17)20(23)24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H2,21,22)(H,23,24)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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DrugBank
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PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
MMDB
PDB
Article
PubMed
2.80E+3 -7.49n/an/an/an/an/a8.022



Cornell University



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Bioorg Med Chem Lett 16: 1610-5 (2006)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)