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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | BRD2 | P25440 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22535 | 0.81 | TSHR (0.36) | TSHRKMT2ABRD4BRD2BLM | |
| Acetic Acid SCHEMBL887070 | 0.75 | BRD4 (0.39) | TSHRKMT2ABRD4BRD2BLM | |
| Acetic Acid SCHEMBL27448041 | 0.74 | BRD4 (0.38) | TSHRKMT2ABRD4BRD2BLM | |
| SCHEMBL14314391 | 0.73 | BLM (0.47) | TSHRKMT2ABRD4BRD2BLM | |
| SCHEMBL7064387 | 0.73 | BLM (0.47) | TSHRKMT2ABRD4BRD2BLM | |
| Hydrogen Peroxide SCHEMBL15262924 | 0.73 | BLM (0.47) | TSHRKMT2ABRD4BRD2BLM | |
| SCHEMBL28324682 | 0.72 | TSHR (0.34) | TSHRKMT2ABLMLMNA | |
| SCHEMBL8218264 | 0.72 | ALDH1A1 (0.37) | TSHRKMT2ALMNAALDH1A1PIK3CD | |
| SCHEMBL8405990 | 0.72 | KMT2A (0.35) | TSHRKMT2ABRD4BLMLMNA | |
| SCHEMBL5815717 | 0.71 | NFE2L2 (0.42) | TSHRKMT2ABRD4BRD2BLM |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130251590-A1 | Peracid/Peroxide Composition, Process for Accurately Making the Same, and Method for Use as an Evaporating Film Anti-Microbial Solution and as a Photosensitizer | BioMed Protect ,LLC (MO) | 2013-09-26 | — | — | US | disclosed |
| EP-2451483-A1 | PERACID/PEROXIDE COMPOSITION, PROCESS FOR ACCURATELY MAKING THE SAME, AND METHOD FOR USE AS AN EVAPORATING FILM ANTI-MICROBIAL SOLUTION AND AS A PHOTOSENSITIZER | Biomed Protect LLC (US) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011005270-A1 | PERACID/PEROXIDE COMPOSITION, PROCESS FOR ACCURATELY MAKING THE SAME, AND METHOD FOR USE AS AN EVAPORATING FILM ANTI-MICROBIAL SOLUTION AND AS A PHOTOSENSITIZER | GOLDEN JEFFRY (US) | 2011-01-13 | — | — | WO | disclosed |