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 | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL432274 | 0.84 | — | — | |
| Methyl Phosphonate SCHEMBL11685446 | 0.82 | LPAR3 (0.40) | MAPTABCC4ALDH1A1LMNATSHR | |
| Acetic Acid SCHEMBL27565407 | 0.79 | MAPT (0.61) | MAPTABCC4ALDH1A1USP2CYP3A4 | |
| SCHEMBL1803840 | 0.77 | DDAH1 (0.55) | MAPTABCC4TSHRDDAH1BLM | |
| SCHEMBL19305284 | 0.77 | DDAH1 (0.55) | MAPTABCC4TSHRDDAH1BLM | |
| SCHEMBL16274192 | 0.77 | DDAH1 (0.55) | MAPTABCC4TSHRDDAH1BLM | |
| Medronic Acid SCHEMBL3977222 | 0.76 | LPAR3 (0.39) | MAPTABCC4ALDH1A1 | |
| SCHEMBL23234380 | 0.75 | TSHR (0.46) | MAPTABCC4ALDH1A1USP2CYP3A4 | |
| SCHEMBL7610315 | 0.75 | TSHR (0.46) | MAPTABCC4ALDH1A1USP2CYP3A4 | |
| SCHEMBL462178 | 0.75 | TSHR (0.46) | MAPTABCC4ALDH1A1USP2CYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102939167-B | Froth flotation process for the separation of silicates and alkaline earth metal carbonates using a collector comprising at least one hydrophobically modified polyalkyleneimine | OMYA DEVELOPMENT AG | 2015-01-07 | — | — | CN | disclosed |
| US-8662311-B2 | Froth flotation process for the separation of silicates and alkaline earth metal carbonates using a collector comprising at least one hydrophobically modified polyalkyleneimine | OMYA INTERNATIONAL AG (CH) | 2014-03-04 | — | — | US | disclosed |
| EP-2366456-B1 | Froth flotation process for the separation of silicates and alkaline earth metal carbonates using a collector comprising at least one hydrophobically modified polyalkyleneimine | OMYA DEVELOPMENT AG (CH) | 2013-10-16 | — | — | EP | disclosed |
| US-20130161239-A1 | FROTH FLOTATION PROCESS FOR THE SEPARATION OF SILICATES AND ALKALINE EARTH METAL CARBONATES USING A COLLECTOR COMPRISING AT LEAST ONE HYDROPHOBICALLY MODIFIED POLYALKYLENEIMINE | OMYA INTERNATIONAL AG (CH) | 2013-06-27 | — | — | US | disclosed |
| CN-102939167-A | Froth flotation process for the separation of silicates and alkaline earth metal carbonates using a collector comprising at least one hydrophobically modified polyalkyleneimine | OMYA DEVELOPMENT AG | 2013-02-20 | — | — | CN | disclosed |
| EP-2366456-A1 | Froth flotation process for the separation of silicates and alkaline earth metal carbonates using a collector comprising at least one hydrophobically modified polyalkyleneimine | Omya Development AG (CH) | 2011-09-21 | — | — | EP | disclosed |