| Name |
Bromfenac (INN) |
| Formula |
C15H12BrNO3 |
| Exact mass |
333.0001 |
| Mol weight |
334.16 |
| Structure |
 |
| Simcomp |
|
| Class |
Anti-inflammatory DG01504 Nonsteroidal anti-inflammatory drug (NSAID) DG01906 Anti-inflammatory drug, acetic acid derivatives DG01898 Anti-inflammatory drug, phenylacetic acid derivative |
| Remark |
ATC code: S01BC11Chemical structure group: DG01128Product (DG01128): D03163<JP/US> |
| Efficacy |
Analgesic, Anti-inflammatory, COX inhibitor |
| Comment |
Nonsteroidal anti-inflammatory drug (NSAID) |
| Target |
PTGS1 (COX1) [HSA:5742] [KO:K00509]PTGS2 (COX2) [HSA:5743] [KO:K11987] |
| Pathway |
hsa00590 Arachidonic acid metabolism |
| Interaction |
|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303] S SENSORY ORGANS S01 OPHTHALMOLOGICALS S01B ANTIINFLAMMATORY AGENTS S01BC Antiinflammatory agents, non-steroids S01BC11 Bromfenac D07541 Bromfenac (INN)Drug groups [BR:br08330] Anti-inflammatory DG01504 Nonsteroidal anti-inflammatory drug (NSAID) DG01906 Anti-inflammatory drug, acetic acid derivatives DG01898 Anti-inflammatory drug, phenylacetic acid derivative DG01128 Bromfenac D07541 BromfenacTarget-based classification of drugs [BR:br08310] Enzymes Oxidoreductases (EC1) Prostaglandin synthase PTGS1 (COX1) D07541 Bromfenac (INN) PTGS2 (COX2) D07541 Bromfenac (INN)Drug groups [BR:br08330] Anti-inflammatory DG01504 Nonsteroidal anti-inflammatory drug (NSAID) DG01906 Anti-inflammatory drug, acetic acid derivatives DG01898 Anti-inflammatory drug, phenylacetic acid derivative DG01128 Bromfenac |
| Other DBs |
CAS: 91714-94-2PubChem: 51091863ChEBI: 240107PDB-CCD: 27R[PDBj] LigandBox: D07541NIKKAJI: J34.696I |
| LinkDB |
|
| KCF data |
ATOM 20 1 C8x C 13.2300 -20.3000 2 C8y C 13.2300 -21.7000 3 C8x C 14.4424 -22.4000 4 C8x C 15.6549 -21.7000 5 C8y C 15.6549 -20.3000 6 C8x C 14.4424 -19.6000 7 C5a C 16.8860 -19.5890 8 C8y C 18.0912 -20.2847 9 X Br 12.0176 -22.4000 10 O5a O 16.8857 -18.2001 11 C8x C 18.0916 -21.6996 12 C8x C 19.3042 -22.3993 13 C8x C 20.5165 -21.6989 14 C8y C 20.5160 -20.2839 15 C8y C 19.3034 -19.5843 16 C1b C 21.7168 -19.5903 17 C6a C 22.9208 -20.2852 18 O6a O 24.1036 -19.6021 19 O6a O 22.9214 -21.6996 20 N1a N 19.3032 -18.2001BOND 21 1 1 2 2 2 2 3 1 3 3 4 2 4 4 5 1 5 5 6 2 6 1 6 1 7 5 7 1 8 7 8 1 9 2 9 1 10 7 10 2 11 8 11 2 12 11 12 1 13 12 13 2 14 13 14 1 15 14 15 2 16 8 15 1 17 14 16 1 18 16 17 1 19 17 18 1 20 17 19 2 21 15 20 1 |
