Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.33 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.33 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Alanine SCHEMBL8584860 | 0.84 | SLC7A5 (0.41) | TP53GABRR1SLC7A5 | |
| Malonaldehyde SCHEMBL4014033 | 0.80 | TP53 (0.40) | TP53GABRR1SLC7A5RNPEPCYP1A2 | |
| Malonaldehyde SCHEMBL7111168 | 0.80 | TP53 (0.40) | TP53GABRR1SLC7A5RNPEPCYP1A2 | |
| Propionaldehyde SCHEMBL28220762 | 0.80 | TDP1 (0.53) | TP53ALDH1A1GABRR1SLC7A5RNPEP | |
| Isopropyl Alcohol SCHEMBL28493903 | 0.79 | — | — | |
| Bromoethane SCHEMBL27453982 | 0.79 | — | — | |
| SCHEMBL27651305 | 0.78 | — | — | |
| SCHEMBL6899221 | 0.78 | GABRR1 (0.44) | TP53TSHRGABRR1SLC7A5 | |
| Acetaldehyde SCHEMBL8145563 | 0.76 | TP53 (0.47) | TP53TSHRGABRR1SLC7A5RNPEP | |
| Formic Acid SCHEMBL9619050 | 0.76 | TP53 (0.47) | TP53ALDH1A1TSHRGABRR1SLC7A5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0474767-B1 | DOPAMINE AGONISTS | ABBOTT LAB (US) | 1996-02-21 | — | — | EP | disclosed |
| EP-0474767-A4 | DOPAMINE AGONISTS | — | 1992-07-08 | — | — | EP | disclosed |
| EP-0474767-A1 | DOPAMINE AGONISTS. | ABBOTT LAB (US) | 1992-03-18 | — | — | EP | disclosed |
| WO-1990015056-A1 | DOPAMINE AGONISTS | ABBOTT LABORATORIES (US) | 1990-12-13 | — | — | WO | disclosed |
| US-4468242-A | Oxime derivatives for promoting the growth of soybeans | CIBA-GEIGY CORPORATION (US) | 1984-08-28 | — | — | US | disclosed |
| US-4269775-A | DERIVATIVES OF PHENYL OR NAPHTHYL ACETONITRILE OXIME-ALKYLENE-DIETHERS; ANTIDOTES FOR HERBICIDES | CIBA-GEIGY CORPORATION (US) | 1981-05-26 | — | — | US | disclosed |