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.
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 SCHEMBL28584351 | 1.00 | — | — | |
| Acetone SCHEMBL11226617 | 0.89 | — | — | |
| Bicarbonate SCHEMBL6685002 | 0.89 | — | — | |
| Carbamic Acid SCHEMBL2286984 | 0.83 | — | — | |
| SCHEMBL93710 | 0.80 | — | — | |
| Glyoxylate SCHEMBL3379774 | 0.80 | — | — | |
| Urea SCHEMBL10348576 | 0.79 | — | — | |
| SCHEMBL5357919 | 0.78 | ALDH1A1 (0.59) | — | |
| SCHEMBL2281294 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL20394242 | 0.76 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57114501-A | — | — | None | — | — | JP | disclosed |
| JP-S57114501-A | BACTERICIDAL AND ALGICIDAL AGENT FOR NONMEDICAL PURPOSE | KUMIAI CHEM IND CO LTD | 1982-07-16 | — | — | JP | disclosed |