Details of the Drug

General Information of Drug (ID: DMD5LXQ)

• Drug Name: 4-fluorophenylboronic acid
• Synonyms: 4-Fluorophenylboronic acid; 1765-93-1; 4-Fluorobenzeneboronic acid; (4-fluorophenyl)boronic acid; 4-Fluorophenyl boronic acid; (4-fluorophenyl)boranediol; p-fluorophenylboronic acid; 4-fluorophenylbornic acid; 4-Fluorophenylboric acid; (4-FLUOROPHENYL)DIHYDROXYBORON; p-fluorobenzeneboronic acid; 4-fluoro phenylboronic acid; C6H6BFO2; 4-Fluoro Phenyl Boronic Acid; CHEMBL344890; (4-fluorophenyl)dihydroxyborane; CHEBI:48661; Boronic acid, (4-fluorophenyl)-; LBUNNMJLXWQQBY-UHFFFAOYSA-N; (P-FLUOROPHENYL)BORIC ACID

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight; 139.92
  Logarithm of the Partition Coefficient; Not Available
  Rotatable Bond Count; 1
  Hydrogen Bond Donor Count; 2
  Hydrogen Bond Acceptor Count; 3
• Chemical Identifiers:
  Formula: C6H6BFO2
  IUPAC Name: (4-fluorophenyl)boronic acid
  Canonical SMILES: B(C1=CC=C(C=C1)F)(O)O
  InChI: InChI=1S/C6H6BFO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,9-10H
  InChIKey: LBUNNMJLXWQQBY-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 285645
  ChEBI ID: CHEBI:48661
  CAS Number: 1765-93-1
  TTD ID: D0K0YF

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Fatty acid amide hydrolase (FAAH)	TTDP1UC	NOUNIPROTAC	Inhibitor	[1]

Molecular Expression Atlas of This Drug

• The Studied Disease: Discovery agent
• ICD Disease Classification: N.A.

Molecule Name	Molecule Type	Gene Name	p-value	Fold-Change	Z-score
Fatty acid amide hydrolase (FAAH)	DTT	NO-GeName	2.65E-01	0.02	0.1

References

• [1] Discovery of boronic acids as novel and potent inhibitors of fatty acid amide hydrolase. J Med Chem. 2008 Nov 27;51(22):7057-60.