Azelaic Acid

Azelaic Acid

SCHEMBL28076544

NCC(=O)O.O=C(O)CCCCCCCC(=O)O

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Azelaic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A known ✓ P27815 1/20 0.57
PDE3A known ✓ Q14432 1/20 0.57
TSHR P16473 6/20 0.75
LMNA P02545 4/20 0.75
NFKB1 P19838 2/20 0.75
PMP22 Q01453 1/20 0.75
KMT2A Q03164 3/20 0.74
ALDH1A1 P00352 3/20 0.74
THRB P10828 2/20 0.74
MEN1 O00255 2/20 0.74
ALOX15 P16050 2/20 0.74
PLG P00747 1/20 0.74
SLC6A2 P23975 1/20 0.74
RECQL P46063 1/20 0.74
SLC6A3 Q01959 1/20 0.74
CYP2D6 P10635 1/20 0.68
BLM P54132 2/20 0.65
NPSR1 Q6W5P4 2/20 0.65
HDAC11 Q96DB2 6/20 0.63
GABRR3 A8MPY1 1/20 0.63

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Azelaic Acid SCHEMBL28549989 1.00 TSHR (0.75) TSHRLMNANFKB1PMP22KMT2A
Glycine SCHEMBL28855970 1.00 TSHR (0.75) TSHRLMNANFKB1PMP22KMT2A
Adipic Acid SCHEMBL15658059 0.97 LMNA (0.73) TSHRLMNANFKB1PMP22KMT2A
Aminocaproic Acid SCHEMBL999851 0.92 LMNA (0.90) TSHRLMNANFKB1PMP22KMT2A
Adipic Acid SCHEMBL541841 0.91 NFKB1 (0.65) TSHRLMNANFKB1PMP22KMT2A
Sebacic Acid SCHEMBL27974435 0.88 LMNA (0.83) TSHRLMNANFKB1PMP22KMT2A
Octanedioate SCHEMBL11875945 0.88 LMNA (0.83) TSHRLMNANFKB1PMP22KMT2A
Azelaic Acid SCHEMBL11141213 0.88 LMNA (0.83) TSHRLMNANFKB1PMP22KMT2A
Decanoic Acid SCHEMBL31288181 0.87 GPR84 (0.81) TSHRLMNAKMT2AALDH1A1MEN1
Sebacic Acid SCHEMBL23045133 0.87 TSHR (0.86) TSHRLMNANFKB1PMP22KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108495646-A For treating and/or the compound of nursing skin, hair, nail and/or mucous membrane 路博润先进材料公司 2018-09-04 CN disclosed
CN-105726387-A Skin whitening microemulsion 佛山市芊茹化妆品有限公司 2016-07-06 CN disclosed