Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 3,4-Dihydroxyphenylacetic 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 | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.76 |
| ▸ | MAPT | P10636 | 4/20 | 0.76 |
| ▸ | TSHR | P16473 | 4/20 | 0.76 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.76 |
| ▸ | APEX1 | P27695 | 2/20 | 0.76 |
| ▸ | THPO | P40225 | 2/20 | 0.76 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.76 |
| ▸ | LMNA | P02545 | 2/20 | 0.76 |
| ▸ | BLM | P54132 | 2/20 | 0.76 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.76 |
| ▸ | RGS12 | O14924 | 1/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.76 |
| ▸ | HPGD | P15428 | 1/20 | 0.76 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.72 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.72 |
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 | |
|---|---|---|---|---|
| Dopamine SCHEMBL30355306 | 0.89 | KDM4E (0.84) | GAATDP1KDM4EMAPTTSHR | |
| Dopamine SCHEMBL28995038 | 0.89 | KDM4E (0.84) | GAATDP1KDM4EMAPTTSHR | |
| Homovanillic Acid SCHEMBL9796291 | 0.89 | TSHR (0.76) | GAATDP1KDM4EMAPTTSHR | |
| Dopamine SCHEMBL29082656 | 0.88 | KDM4E (0.79) | GAATDP1KDM4EMAPTTSHR | |
| Dopamine SCHEMBL5441164 | 0.87 | KDM4E (0.81) | GAATDP1KDM4EMAPTTSHR | |
| 3,4-Dihydroxyphenylacetic Acid SCHEMBL36348 | 0.87 | GAA (1.00) | GAATDP1KDM4EMAPTTSHR | |
| 3,4-Dihydroxyphenylacetic Acid SCHEMBL29382155 | 0.87 | GAA (1.00) | GAATDP1KDM4EMAPTTSHR | |
| Dopamine SCHEMBL28940538 | 0.86 | KDM4E (0.72) | GAATDP1KDM4EMAPTTSHR | |
| Dopamine SCHEMBL11668670 | 0.86 | KDM4E (0.78) | GAATDP1KDM4EMAPTTSHR | |
| Dopamine SCHEMBL29245423 | 0.86 | KDM4E (0.78) | GAATDP1KDM4EMAPTTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109633140-B | Method for evaluating neurodevelopment toxicity of perfluorinated compounds by using zebra fish | 中国环境科学研究院 | 2020-06-26 | — | — | CN | disclosed |
| US-5783680-A | MONAMINE OXIDASE GENE AND PROTEIN | THE GENERAL HOSPITAL CORPORATION (US) | 1998-07-21 | — | — | US | disclosed |