UCSF

ZINC00584092

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 25 Yes

CAS Numbers: , 49562-28-9 , [49562-28-9]

Other Names:

fibrate

2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropanoic acid 1-methylethyl ester; Ankebin; Antara; BRN 2062462; C20H21ClO4; CCRIS 7282; EINECS 256-376-3; Elasterate; Elasterin; FENOFIBRATE; FENOFIBRATE (MICRONIZED); Fenobrate; Fenofibrate [INN:BAN]; Fenofibrato

2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropanoic acid 1-methylethyl ester; FNF; Fenofibrate; Finofibrate; Isopropyl (4'-(p-chlorobenzoyl)-2-phenoxy-2-methyl)propionate; Isopropyl 2-(4-(4-chlorobenzoyl)phenoxy)-2-methylpropionate; Lipantil (TN); Procetofen

2-[4-(4-Chlorobenzoyl)phenoxy]-2-methylpropanoic acid isopropyl ester

49562-28-9

49562-28-9; Antara (TN); D00565; Fenofibrate (JAN/INN); Lipantil (TN); Lipofen (TN); Tricor (TN); Triglide (TN)

49562-28-9; C07586; Fenofibrate

49562-28-9; CPD000058299; FENOFIBRATE; SAM002264613

49562-28-9; Fenofibrate; Prestwick_217

AB00052196

Abbott Brand of Procetofen

AbZ Brand of Procetofen

AC-4227

AC1L1FPK

AKOS005107777

Aliud Brand of Procetofen

Ankebin

Antara

Antara (micronized)

Antara (TN)

Antara Micronized Procetofen

Antara, Fenoglide, Fibricor, Lipofen, Lofibra, Triglide

Anto Brand of Procetofen

Apo Feno Micro

Apo Fenofibrate

Apo-Feno-Micro

Apo-Fenofibrate

Apotex Brand of Procetofen

AZU, Fenofibrat

Azupharma Brand of Procetofen

BAN

betapharm Brand of Procetofen

BIDD:GT0574

Bouchara Brand of Procetofen

BPBio1_000166

BRD-K50388907-001-05-6

BRD-K50388907-001-18-9

BRN 2062462

BSPBio_000150

BSPBio_003162

C07586

C20H21ClO4

CAS-49562-28-9

CCRIS 7282

CHEBI:5001

CHEMBL672

CID3339

CIP-Fenofibrate

Controlip

CPD000058299

CPD000058299; Fenofibrate; SAM002264613

ct Arzneimittel Brand of Procetofen

ct-Arzneimittel Brand of Procetofen

D00565

D011345

DAP000270

DB01039

Debat, Fenofibrate

DivK1c_000557

durafenat

EINECS 256-376-3

Elasterate

Elasterin

EU-0100486

F 6020

F6020_SIGMA

FDA

Fenobeta

Fenobrate

Fenofanton

Fenofibrat AbZ

Fenofibrat AL

Fenofibrat AZU

Fenofibrat FPh

Fenofibrat Heumann

Fenofibrat Hexal

Fenofibrat ratiopharm

Fenofibrat Stada

fenofibrat von ct

Fenofibrat-ratiopharm

Fenofibrate (BAN

Fenofibrate (FDA

Fenofibrate (JAN/INN)

Fenofibrate (MI

FENOFIBRATE (MICRONIZED)

Fenofibrate (Tricor, Trilipix)

Fenofibrate Debat

Fenofibrate IDD-P

Fenofibrate MSD

Fenofibrate [INN:BAN]

Fenofibrato

Fenofibrato [INN-Spanish]

Fenofibrato [INN-Spanish];Fenofibratum [INN-Latin];Fenofibric acid;Finofibrate;FNF

Fenofibratum

Fenofibratum [INN-Latin]

Fenofibric acid

Fenogal

Fenoglide

Fenomax

Fenotard

Finofibrate

FNF

Fournier Brand of Procetofen

Fulcro

Gate Brand of Procetofen

Gen Fenofibrate

Gen-Fenofibrate

Genpharm Brand of Procetofen

GNR Pharma Brand of Procetofen

GNR-Pharma Brand of Procetofen

GRS-027

Heumann Brand of Procetofen

Heumann, Fenofibrat

Hexal Brand of Procetofen

Hexal, Fenofibrat

HMS1568H12

HMS1921B17

HMS2090G20

HMS2092B05

HMS501L19

I06-0048

IDI1_000557

INN

INN)

Isopropyl 2-(4-(4-chlorobenzoyl)phenoxy)-2-methylpropanoate

Isopropyl 2-(4-(4-chlorobenzoyl)phenoxy)-2-methylpropionate

Isopropyl 2-(p-(p-chlorobenzoyl)phenoxy)-2-methylpropionate

isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate

KBio1_000557

KBio2_001730

KBio2_004298

KBio2_006866

KBio3_002382

KBioGR_000706

KBioSS_001730

Knoll Brand of Procetofen

LCP-Feno

LCP-FenoChol

LF 178

LF-178

LF178

Lichtenstein Brand of Procetofen

Lipanthyl

Lipantil

Lipantil (TN)

Liparison

Lipidex

Lipidil

Lipidil Micro

Lipidil Supra

Lipidil Ter

Lipidil-Ter

Lipifen

Lipirex

Lipoclar

Lipofen

Lipofen (TN)

Lipofene

Liposit

Lipsin

Lofibra

LS-121256

Luxacor

Merck dura Brand of Procetofen

MFCD00133314

MI)

Micronized Procetofen, Antara

MLS000028515

MLS001148191

MolPort-002-887-051

MTW Brand of Procetofen

MTW Fenofibrat

MTW-Fenofibrat

NCGC00015437-01

NCGC00015437-02

NCGC00015437-03

NCGC00015437-06

NCGC00015437-12

NCGC00021475-03

NCGC00021475-04

NCGC00021475-05

NCGC00021475-06

NCGC00021475-07

NCGC00021475-08

nchembio790-comp24

NINDS_000557

Nolipax

Novartis Brand of Procetofen

Novo Fenofibrate

Novo-Fenofibrate

Novopharm Brand of Procetofen

NSC 281319

NSC281319

Nu Fenofibrate

Nu Pharm Brand of Procetofen

Nu-Fenofibrate

Nu-Pharm Brand of Procetofen

Pharmascience Brand of Procetofen

Pharmavit

Phenofibrate

PMS Fenofibrate Micro

PMS-Fenofibrate Micro

Prestwick0_000275

Prestwick1_000275

Prestwick2_000275

Prestwick3_000275

Prestwick_217

Procetofen

Procetofen Reliant Brand

Procetofen, Antara Micronized

Procetofene

Proctofene

propanoic acid, 2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-, 1-methylethyl ester

Protolipan

Q Pharm Brand of Procetofen

Q-Pharm Brand of Procetofen

QA-6653

ratiopharm Brand of Procetofen

Reliant Brand of Procetofen

S1794_Selleck

SAM002264613

Schering Plough Brand of Procetofen

Schering-Plough Brand of Procetofen

Secalip

Sedufen

SMR000058299

SPBio_001380

SPBio_002369

SPECTRUM1501010

Spectrum2_001390

Spectrum3_001431

Spectrum4_000413

Spectrum5_001479

Spectrum_001250

ST085313

Stada, Fenofibrat

Stadapharm Brand of Procetofen

Supralip

TL8003296

Tricor

TRICOR (MICRONIZED)

Tricor (TN)

Triglide

Triglide (TN)

Trilipix

UNII-U202363UOS

United Drug Brand of Procetofen

ZINC00584092

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.54 11.71 -10.11 0 4 0 53 360.837 7

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 7.07e-04 g/l DrugBank-approved
Purity 95% Fluorochem
UniProt Database Links ABCD1_MOUSE; AOXA_MOUSE; HYES_HUMAN; HYES_MOUSE; HYES_RAT; IL27A_MOUSE ChEBI
Therapy antihyperlipidemic SMDC Iconix
Patent Database Links EP1258253; EP1522310; EP1553091; EP1559419; EP1559710; EP1621200; EP1655037; EP1690530; EP1707196; EP1707197; EP1714648; EP1738757; EP1746099; EP1785133; EP1785144; EP1803441; EP1808163; EP1832576; EP1864680; EP1884513; EP1889847; EP1894567; EP1911462; EP ChEBI
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : F-3539 NIH Clinical Collection via PubChem
Target NULL Selleck Chemicals
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: F-3539 NIH Clinical Collection via PubChem

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
FABPL-3-E Fatty Acid-binding Protein, Liver (cluster #3 Of 4), Eukaryotic Eukaryotes 62 0.40 Binding ≤ 10μM
PPARA-1-E Peroxisome Proliferator-activated Receptor Alpha (cluster #1 Of 3), Eukaryotic Eukaryotes 3210 0.31 Binding ≤ 10μM
PPARG-1-E Peroxisome Proliferator-activated Receptor Gamma (cluster #1 Of 2), Eukaryotic Eukaryotes 570 0.35 Binding ≤ 10μM
PPARA-1-E Peroxisome Proliferator-activated Receptor Alpha (cluster #1 Of 2), Eukaryotic Eukaryotes 2000 0.32 Functional ≤ 10μM
Z50425-1-O Plasmodium Falciparum (cluster #1 Of 22), Other Other 7943 0.29 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
FABPL_RAT P02692 Fatty Acid-binding Protein, Liver, Rat 130 0.39 Binding ≤ 1μM
PPARA_HUMAN Q07869 Peroxisome Proliferator-activated Receptor Alpha, Human 1000 0.34 Binding ≤ 1μM
PPARG_HUMAN P37231 Peroxisome Proliferator-activated Receptor Gamma, Human 570 0.35 Binding ≤ 1μM
FABPL_RAT P02692 Fatty Acid-binding Protein, Liver, Rat 130 0.39 Binding ≤ 10μM
PPARA_HUMAN Q07869 Peroxisome Proliferator-activated Receptor Alpha, Human 1000 0.34 Binding ≤ 10μM
PPARG_HUMAN P37231 Peroxisome Proliferator-activated Receptor Gamma, Human 570 0.35 Binding ≤ 10μM
PPARA_HUMAN Q07869 Peroxisome Proliferator-activated Receptor Alpha, Human 2000 0.32 Functional ≤ 10μM
Z50425 Z50425 Plasmodium Falciparum 7943.28235 0.29 Functional ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Activation of gene expression by SREBF (SREBP)
BMAL1:CLOCK,NPAS2 activates circadian gene expression
Circadian Clock
Nuclear Receptor transcription pathway
PPARA activates gene expression
Regulation of lipid metabolism by Peroxisome proliferator-activated receptor alp
REV-ERBA represses gene expression
RORA activates circadian gene expression
Transcriptional activation of mitochondrial biogenesis
Transcriptional regulation of white adipocyte differentiation
YAP1- and WWTR1 (TAZ)-stimulated gene expression

Analogs ( Draw Identity 99% 90% 80% 70% )