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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | MIF | P14174 | 1/20 | 0.53 |
| ▸ | TYR | P14679 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 2/20 | 0.49 |
| ▸ | RARG | P13631 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL18315853 | 0.94 | ALDH1A1 (0.57) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| Benzene SCHEMBL28155736 | 0.90 | ALDH1A1 (0.61) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| SCHEMBL109921 | 0.90 | ALDH1A1 (0.67) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| SCHEMBL29364103 | 0.90 | ALDH1A1 (0.67) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| Formaldehyde SCHEMBL11408443 | 0.88 | ALDH1A1 (0.59) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| Fluoride SCHEMBL29290988 | 0.88 | ALDH1A1 (0.64) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| SCHEMBL3859151 | 0.88 | ALDH1A1 (0.64) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| Hydrochloric Acid SCHEMBL4359705 | 0.88 | ALDH1A1 (0.64) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| SCHEMBL30621342 | 0.88 | ALDH1A1 (0.64) | ALDH1A1ALOX15HSD17B10TDP1HPGD | |
| SCHEMBL28420832 | 0.88 | ALDH1A1 (0.64) | ALDH1A1ALOX15HSD17B10TDP1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4342473-A | Pressure-sensitive copy systems containing phenolic ester as color-stabilizers | CHAMPION INTERNATIONAL CORPORATION (US) | 1982-08-03 | — | — | US | disclosed |