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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | PLA2G2C | Q5R387 | 7/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.42 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.42 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL27583636 | 0.98 | HSD17B10 (0.55) | HSD17B10USP2PLA2G2CHTTCES2 | |
| Acetic Acid SCHEMBL3249565 | 0.94 | HSD17B10 (0.59) | HSD17B10USP2PLA2G2CHTTCES2 | |
| SCHEMBL7666643 | 0.90 | HSD17B10 (0.70) | HSD17B10USP2HTTSPHK1MAPT | |
| SCHEMBL535931 | 0.90 | HSD17B10 (0.70) | HSD17B10USP2HTTSPHK1MAPT | |
| SCHEMBL7149906 | 0.90 | HSD17B10 (0.70) | HSD17B10USP2HTTSPHK1MAPT | |
| SCHEMBL186489 | 0.88 | HSD17B10 (0.67) | HSD17B10USP2PLA2G2CHTTSPHK1 | |
| SCHEMBL4865243 | 0.88 | HSD17B10 (0.67) | HSD17B10USP2PLA2G2CHTTSPHK1 | |
| SCHEMBL7661581 | 0.88 | HSD17B10 (0.67) | HSD17B10USP2PLA2G2CHTTSPHK1 | |
| SCHEMBL10745894 | 0.88 | HSD17B10 (0.67) | HSD17B10USP2PLA2G2CHTTSPHK1 | |
| SCHEMBL7549303 | 0.88 | HSD17B10 (0.67) | HSD17B10USP2PLA2G2CHTTSPHK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105814162-B | Solvent compositions are used in electric device manufacture | 株式会社大赛璐 | 2019-03-29 | — | — | CN | disclosed |