acompound

Showing entry for Azelaic acid

General Compound Information
BXGC Id	BXGC0005894
Compound Name	Azelaic acid
Structure
Formula	C9H16O4
InchiKey	BDJRBEYXGGNYIS-UHFFFAOYSA-N
SMILES	OC(=O)CCCCCCCC(O)=O
Inchi	InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13)
IUPAC	nonanedioic acid
Molecular Weight	188.22
Pubchem Id	2266
Chembl Id	CHEMBL1238

Targets of Information Source

DrugBank

DB00548

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
P66010	BXGT011546	Thioredoxin reductase	reviewed	-	trxB	approved	inhibitor
P51857	BXGT010899	Aldo-keto reductase family 1 member D1	reviewed	Enzyme	AKR1D1	approved	inhibitor
P31213	BXGT009515	3-oxo-5-alpha-steroid 4-dehydrogenase 2	reviewed	Enzyme	SRD5A2	approved	inhibitor
P14679	BXGT008039	Tyrosinase	reviewed	Enzyme	TYR	approved	inhibitor
P00582	BXGT005588	DNA polymerase I	reviewed	-	polA	approved	inhibitor

PDB

AZ1

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Q58497	BXGT015191	Diaminopimelate decarboxylase	reviewed	lysA	-	89000	-	-	-

Binding DB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM

CHEMBL

CHEMBL1238

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	AC50	-	-	-
Q01453	BXGT012588	Peripheral myelin protein 22	reviewed	Cellular structure	PMP22	Potency	'='	95283	nM
O15648	BXGT004185	ATP-dependent 6-phosphofructokinase	reviewed	-	pfk	Potency	-	756	nM
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	AC50	-	-	-
Q9F4F7	BXGT020344	4'-phosphopantetheinyl transferase ffp	reviewed	-	ffp	Potency	'='	3162	nM
Q96KQ7	BXGT019687	Histone-lysine N-methyltransferase EHMT2	reviewed	Epigenetic regulator	EHMT2	Potency	-	47	nM
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	AC50	-	-	-
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	AC50	-	-	-
P02545	BXGT005889	Prelamin-A/C	reviewed	-	LMNA	Potency	'='	5	nM
Q9UIF8	BXGT021718	Bromodomain adjacent to zinc finger domain protein 2B	reviewed	-	BAZ2B	Potency	-	631	nM
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	AC50	-	-	-
Q9NR56	BXGT021179	Muscleblind-like protein 1	reviewed	Nucleic acid binding	MBNL1	Potency	-	205750	nM
P00811	BXGT005666	Beta-lactamase	reviewed	-	ampC	Inhibition	'<'	5	%
Q9NR56	BXGT021179	Muscleblind-like protein 1	reviewed	Nucleic acid binding	MBNL1	Potency	-	4105	nM
P16473	BXGT008234	Thyrotropin receptor	reviewed	G-protein coupled receptor	TSHR	Potency	'='	6309	nM
Q99895	BXGT019974	Chymotrypsin-C	reviewed	-	CTRC	Inhibition	'<'	5	%
P02545	BXGT005889	Prelamin-A/C	reviewed	-	LMNA	Potency	'='	100	nM
P02791	BXGT005965	Ferritin light chain	reviewed	-	FTL	Potency	'='	316	nM
P40925	BXGT010206	Malate dehydrogenase, cytoplasmic	reviewed	Enzyme	MDH1	Inhibition	'='	8	%
P19838	BXGT008526	Nuclear factor NF-kappa-B p105 subunit	reviewed	Transcription factor	NFKB1	Potency	'='	2	nM
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	14	nM
Q13148	BXGT013318	TAR DNA-binding protein 43	reviewed	-	TARDBP	Potency	-	11220	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	1258	nM
Q9Y6L6	BXGT022334	Solute carrier organic anion transporter family member 1B1	reviewed	Transporter	SLCO1B1	Inhibition	'='	100	%
P15289	BXGT008102	Arylsulfatase A	reviewed	Enzyme	ARSA	Potency	-	37933	nM
Q9NPD5	BXGT021151	Solute carrier organic anion transporter family member 1B3	reviewed	Transporter	SLCO1B3	Inhibition	'='	107	%
Q9NR56	BXGT021179	Muscleblind-like protein 1	reviewed	Nucleic acid binding	MBNL1	Potency	-	19952	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00049	Chicory	Cichorium intybus	Vegetables
BXGF00134	Common bean	Phaseolus vulgaris	Pulses
BXGF00175	Potato	Solanum tuberosum	Vegetables
BXGF00292	Butternut squash	Cucurbita moschata	Gourds
BXGF00352	Japanese chestnut	Castanea crenata	Nuts
BXGF00877	Tripteris microcarpa	Tripteris microcarpa	Others
BXGF01003	Carpobrotus edulis	Carpobrotus edulis	Medicinal Plant
BXGF01045	Dioscorea japonica	Dioscorea japonica	Medicinal Plant
BXGF01062	Asplenium normale	Asplenium normale	Others
BXGF01070	Himalaiella deltoidea	Himalaiella deltoidea	Others
BXGF01123	Ranunculus ternatus	Ranunculus ternatus	Others
BXGF01137	Centrolobium tomentosum	Centrolobium tomentosum	Others
BXGF01185	Aloe vera	Aloe vera	Medicinal Plant
BXGF01201	Psilostrophe cooperi	Psilostrophe cooperi	Others
BXGF01234	Cylindropuntia leptocaulis	Cylindropuntia leptocaulis	Human Edible Plant
BXGF01305	Trifolium alexandrinum	Trifolium alexandrinum	Medicinal Plant
BXGF01507	Sideritis tragoriganum	Sideritis tragoriganum	Others
BXGF01778	Solanum jamaicense	Solanum jamaicense	Others
BXGF01832	Dalbergia ecastaphyllum	Dalbergia ecastaphyllum	Medicinal Plant
BXGF01895	Lippia carviodora	Lippia carviodora	Medicinal Plant
BXGF01900	Aloe ferox	Aloe ferox	Medicinal Plant
BXGF01912	Ceratophyllum submersum	Ceratophyllum submersum	Others
BXGF01936	Brucea javanica	Brucea javanica	Medicinal Plant
BXGF01971	Myrica nana	Myrica nana	Others
BXGF02049	Angelica sinensis	Angelica sinensis	Medicinal Plant
BXGF02061	Dracocephalum kotschyi	Dracocephalum kotschyi	Medicinal Plant
BXGF02221	Phlojodicarpus sibiricus	Phlojodicarpus sibiricus	Medicinal Plant
BXGF02377	Cichorium glandulosum	Cichorium glandulosum	Others
BXGF02397	Pithecellobium racemosum	Pithecellobium racemosum	Others
BXGF02737	Artemisia scoparia	Artemisia scoparia	Medicinal Plant
BXGF02859	Bulbinella floribunda	Bulbinella floribunda	Others
BXGF03117	Myoporum platycarpum	Myoporum platycarpum	Medicinal Plant
BXGF03300	Blumea eriantha	Blumea eriantha	Medicinal Plant
BXGF03374	Cipadessa fruticosa	Cipadessa fruticosa	Others
BXGF03649	Palaquium canaliculatum	Palaquium canaliculatum	Others
BXGF03665	Physalis sordida	Physalis sordida	Others
BXGF03785	Taxus drupacea	Taxus drupacea	Others
BXGF03803	Ilex brevicuspis	Ilex brevicuspis	Human Edible Plant
BXGF03831	Acrisione denticulata	Acrisione denticulata	Others
BXGF03845	Senecio heliopsis	Senecio heliopsis	Others
BXGF03851	Berberis orthobotrys	Berberis orthobotrys	Medicinal Plant
BXGF03871	Codium dwarkense	Codium dwarkense	Others
BXGF03878	Achillea biebersteinii	Achillea biebersteinii	Medicinal Plant
BXGF03898	Dioscorea polystachya	Dioscorea polystachya	Medicinal Plant
BXGF03904	Euphorbia formosana	Euphorbia formosana	Others
BXGF03912	Diplazium esculentum	Diplazium esculentum	Medicinal Plant
BXGF03944	Ongokea gore	Ongokea gore	Medicinal Plant
BXGF03946	Sanicula epipactis	Sanicula epipactis	Others
BXGF03958	Euonymus laxiflorus	Euonymus laxiflorus	Others
BXGF03989	Scopolia atropoides	Scopolia atropoides	Others
BXGF04003	Maackia floribunda	Maackia floribunda	Others
BXGF04005	Caryocar villosum	Caryocar villosum	Medicinal Plant
BXGF04013	Ocimum gratissimum	Ocimum gratissimum	Medicinal Plant
BXGF04019	Glochidion philippicum	Glochidion philippicum	Others
BXGF04024	Ceriops decandra	Ceriops decandra	Medicinal Plant
BXGF04027	Solidago petiolaris	Solidago petiolaris	Others
BXGF04034	Zaluzania grayana	Zaluzania grayana	Others
BXGF04052	Zanthoxylum acutifolium	Zanthoxylum acutifolium	Medicinal Plant
BXGF04071	Archidendron ellipticum	Archidendron ellipticum	Others
BXGF04082	Tabernaemontana divaricata	Tabernaemontana divaricata	Medicinal Plant
BXGF04361	Cynomorium songaricum	Cynomorium songaricum	Medicinal Plant
BXGF04428	Baccharis dracunculifolia	Baccharis dracunculifolia	Medicinal Plant
BXGF04495	Trichilia catigua	Trichilia catigua	Medicinal Plant
BXGF04512	Philadelphus coronarius	Philadelphus coronarius	Garden Plant
BXGF04517	Pterocarpus macrocarpus	Pterocarpus macrocarpus	Medicinal Plant
BXGF04520	Meliosma wightii	Meliosma wightii	Others
BXGF04525	Simaba cuneata	Simaba cuneata	Human Edible Plant
BXGF04545	Thalictrum podocarpum	Thalictrum podocarpum	Others
BXGF04572	Polygala fruticosa	Polygala fruticosa	Medicinal Plant
BXGF04582	Huperzia selago	Huperzia selago	Medicinal Plant
BXGF04593	Kielmeyera rubriflora	Kielmeyera rubriflora	Others
BXGF04613	Turbina corymbosa	Turbina corymbosa	Medicinal Plant
BXGF04615	Sorbaria arborea	Sorbaria arborea	Others
BXGF04620	Scandix pecten-veneris	Scandix pecten-veneris	Medicinal Plant
BXGF04625	Syzygium levinei	Syzygium levinei	Others
BXGF04631	Aloe spicata	Aloe spicata	Medicinal Plant
BXGF04632	Corydalis pallida	Corydalis pallida	Medicinal Plant
BXGF04644	Chasmanthera dependens	Chasmanthera dependens	Medicinal Plant
BXGF04654	Senecio miser	Senecio miser	Others
BXGF04658	Larix lyallii	Larix lyallii	Medicinal Plant
BXGF04662	Crepis czerepanovii	Crepis czerepanovii	Others
BXGF04666	Campanula hypopolia	Campanula hypopolia	Others
BXGF04673	Hymenoxys grandiflora	Hymenoxys grandiflora	Others
BXGF04678	Urginea riparia	Urginea riparia	Others
BXGF04691	Oroxylum indicum	Oroxylum indicum	Medicinal Plant
BXGF04694	Pteris pedata	Pteris pedata	Others
BXGF04706	Othonna tagetes	Othonna tagetes	Others
BXGF04710	Agave cocui	Agave cocui	Others
BXGF04793	Vincetoxicum atratum	Vincetoxicum atratum	Medicinal Plant
BXGF04802	Hibiscus syriacus	Hibiscus syriacus	Medicinal Plant
BXGF04926	Aloe africana	Aloe africana	Medicinal Plant
BXGF04961	Carthamus oxyacantha	Carthamus oxyacantha	Others
BXGF05358	Codonopsis radix	Codonopsis radix	Others
BXGF05919	Dioscorea opposita	Dioscorea opposita	Human Edible Plant
BXGF06182	Ventilago madraspatana	Ventilago madraspatana	Medicinal Plant

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}