Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Acrylic 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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CTSD | P07339 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL7179511 | 0.97 | ALDH1A1 (0.53) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| Acrylic Acid SCHEMBL7179546 | 0.97 | ALDH1A1 (0.53) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4588663 | 0.89 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9125311 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL124875 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| Zinc Ion SCHEMBL4587798 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4588661 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21433686 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| Potassium Ion SCHEMBL625576 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13571477 | 0.86 | ALDH1A1 (0.63) | ALDH1A1CTSDCYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6630079-B2 | Bis(2- pyridinethiol-1-oxide) copper salt, does not exert any adverse influence on the storage stability or antifouling effect, and the effect of the salt does not change by the coating with an acrylic resin | API CORPORATION (JP) | 2003-10-07 | — | — | US | disclosed |
| EP-1080640-B1 | COATED BIS(2-PYRIDINETHIOL-1-OXIDE)COPPER SALT | API CORP (JP) | 2003-09-10 | — | — | EP | disclosed |
| US-20030124085-A1 | Coated bis (2-pyridinethiol-1-oxide) copper salt | API CORPORATION (JP) | 2003-07-03 | — | — | US | disclosed |
| US-6544440-B1 | Antifouling active ingredient for a coating for the bottom of a ship, which is safe during handling; rosin coated; biocides | API CORPORATION (JP) | 2003-04-08 | — | — | US | disclosed |
| EP-1227111-A1 | TRIPHENYLBORON-CONTAINING POLYMERS AND USE THEREOF | Yoshitomi Fine Chemicals, Ltd. (JP) | 2002-07-31 | — | — | EP | disclosed |
| EP-1080640-A1 | COATED BIS(2-PYRIDINETHIOL 1-OXIDE) COPPER SALT | Yoshitomi Fine Chemicals, Ltd. (JP) | 2001-03-07 | — | — | EP | disclosed |