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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 12/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 12/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | KDM7A | Q6ZMT4 | 1/20 | 0.38 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.38 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7502000 | 0.96 | KDM4A (0.40) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| SCHEMBL22599 | 0.96 | KDM4A (0.40) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| Methacrylic Acid SCHEMBL1844179 | 0.94 | PAOX (0.38) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| Hydrochloric Acid SCHEMBL966902 | 0.94 | KDM4A (0.43) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| Ammonia Solution, Strong SCHEMBL9070327 | 0.94 | KDM4A (0.39) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| Bromide SCHEMBL1061717 | 0.94 | KDM4A (0.39) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| SCHEMBL4859244 | 0.92 | KDM4A (0.46) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| Iodomethane SCHEMBL3333482 | 0.92 | KDM4A (0.38) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| SCHEMBL4242756 | 0.92 | KDM4A (0.38) | PAOXKDM4AKDM4CKDM5AKDM7A | |
| Bromomethane SCHEMBL3331850 | 0.92 | KDM4A (0.38) | PAOXKDM4AKDM4CKDM5AKDM7A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180163056-A1 | HYDROPHILIC CURABLE COMPOSITIONS | MITSUI CHEMICALS, INC. (JP) | 2018-06-14 | — | — | US | disclosed |
| US-20180036995-A1 | HYDROPHILIC MONOLAYER FILM WITH OPTICAL FUNCTIONALITY AND STACK OF THE SAME | MITSUI CHEMICALS, INC. (JP) | 2018-02-08 | — | — | US | disclosed |
| EP-3270192-A1 | HYDROPHILIC SINGLE-LAYER FILM HAVING OPTICAL FUNCTIONALITY, AND LAMINATE THEREOF | Mitsui Chemicals, Inc. (JP) | 2018-01-17 | — | — | EP | disclosed |
| EP-3081578-A1 | COMPOSITION FOR HYDROPHILIC CURED PRODUCT | Mitsui Chemicals, Inc. (JP) | 2016-10-19 | — | — | EP | disclosed |
| EP-1545894-A1 | COMPOSITIONS FOR INK-JET INK-RECEPTOR SHEETS | 3M Innovative Properties Company (US) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004028821-A1 | COMPOSITIONS FOR INK-JET INK-RECEPTOR SHEETS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2004-04-08 | — | — | WO | disclosed |
| US-20040059045-A1 | Water resistant inkjet photo paper | 3M INNOVATIVE PROPERTIES COMPANY | 2004-03-25 | — | — | US | disclosed |