Acetic Acid

Acetic Acid

SCHEMBL30910171

CC(=O)O.CC(=O)O.CCC(N)(N)C(=O)NCc1ccccc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRK1 known ✓ P41145 1/20 0.48
RIPK1 Q13546 1/20 0.64
MMP8 P22894 3/20 0.50
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
PPID Q08752 1/20 0.47
LMNA P02545 2/20 0.46
RAB9A P51151 1/20 0.45
EPHX2 P34913 1/20 0.45
CYP3A4 P08684 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PTPN1 P18031 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL557055 0.97 RIPK1 (0.68) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL10937862 0.81 RIPK1 (0.64) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL2746269 0.80 RIPK1 (0.67) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL1709321 0.78 RIPK1 (1.00) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL1709337 0.78 RIPK1 (0.75) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL27776096 0.77 RIPK1 (0.59) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL27776098 0.77 RIPK1 (0.59) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL25464672 0.77 RIPK1 (0.68) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL10990271 0.77 RIPK1 (0.68) RIPK1MMP8ALDH1A1MAPTOPRK1
SCHEMBL7438658 0.77 RIPK1 (0.68) RIPK1MMP8ALDH1A1MAPTOPRK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117860606-A Anti-aging cosmetic composition and application thereof 杭州毛戈平科技有限公司 2024-04-12 CN claimed
CN-117860606-A Anti-aging cosmetic composition and application thereof 杭州毛戈平科技有限公司 2024-04-12 CN disclosed
CN-117860606-A Anti-aging cosmetic composition and application thereof 杭州毛戈平科技有限公司 2024-04-12 CN disclosed