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 | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL470628 | 0.87 | GABRA1 (0.48) | GABRA1GABRB2CYP3A4TRPA1CYP1A2 | |
| Benzoic Acid SCHEMBL11538211 | 0.87 | NAPRT (0.50) | GABRA1GABRB2MYCKMT2ACYP3A4 | |
| Iodide SCHEMBL9504981 | 0.85 | GABRA1 (0.46) | GABRA1GABRB2CYP3A4TRPA1CYP1A2 | |
| Water SCHEMBL2496499 | 0.85 | GABRA1 (0.46) | GABRA1GABRB2CYP3A4TRPA1CYP1A2 | |
| Hydrochloric Acid SCHEMBL659883 | 0.85 | GABRA1 (0.46) | GABRA1GABRB2CYP3A4TRPA1CYP1A2 | |
| Bromide SCHEMBL660019 | 0.85 | GABRA1 (0.46) | GABRA1GABRB2CYP3A4TRPA1CYP1A2 | |
| Phosphoric Acid SCHEMBL7178344 | 0.84 | GABRA1 (0.44) | GABRA1GABRB2TRPA1TDP1HPGD | |
| Boric Acid SCHEMBL7183370 | 0.83 | GABRA1 (0.47) | GABRA1GABRB2TRPA1CYP1A2TDP1 | |
| SCHEMBL7180493 | 0.83 | GABRA1 (0.47) | GABRA1GABRB2KMT2ATRPA1MEN1 | |
| Acetic Acid SCHEMBL1047016 | 0.80 | HPGD (0.40) | GABRA1GABRB2MYCKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0337322-B1 | PROCESS FOR PRODUCING MONOSILANE | MITSUBISHI KASEI CORPORATION (JP) | 1993-07-21 | — | — | EP | disclosed |
| US-4904460-A | Process for producing monosilane | MITSUBISHI KASEI CORPORATION (JP) | 1990-02-27 | — | — | US | disclosed |
| EP-0337322-A2 | Process for producing monosilane | MITSUBISHI KASEI CORPORATION (JP) | 1989-10-18 | — | — | EP | disclosed |