Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 9/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PDE7B | Q9NP56 | 3/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | FBP1 | P09467 | 1/20 | 0.33 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 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 | |
|---|---|---|---|---|
| SCHEMBL27051255 | 0.72 | CYP2A6 (0.45) | ALDH1A1MEN1KMT2ACYP2A6 | |
| SCHEMBL12728634 | 0.71 | ALDH1A1 (0.61) | ALDH1A1MEN1KMT2APDE7ATDP1 | |
| SCHEMBL9740858 | 0.71 | USP7 (0.42) | ALDH1A1MEN1KMT2APDE7ATDP1 | |
| SCHEMBL9739624 | 0.71 | LMNA (0.46) | ALDH1A1MEN1KMT2APDE7ATDP1 | |
| SCHEMBL9711256 | 0.70 | KIF18A (0.37) | ALDH1A1TDP1CYP2A6MAPTTSHR | |
| SCHEMBL9711238 | 0.70 | CYP2A6 (0.37) | ALDH1A1MEN1KMT2ATDP1CYP2A6 | |
| SCHEMBL9711273 | 0.69 | KMT2A (0.37) | ALDH1A1MEN1KMT2APDE7ATDP1 | |
| SCHEMBL9711280 | 0.69 | CYP3A4 (0.44) | ALDH1A1MEN1KMT2ATDP1TSHR | |
| SCHEMBL9711236 | 0.69 | TDP1 (0.40) | ALDH1A1MEN1KMT2APDE7ATDP1 | |
| SCHEMBL15352079 | 0.68 | CYP2A6 (0.48) | MEN1KMT2ACYP2A6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5153227-A | Treatment of diabetes and galactosemia complications | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-10-06 | — | — | US | disclosed |
| EP-0304190-B1 | (ARYLSULPHONYL)NITROMETHANES, PROCESS FOR THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-07-08 | — | — | EP | disclosed |
| EP-0304190-A1 | (Arylsulphonyl)nitromethanes, process for their preparation and use in pharmaceutical compositions | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-02-22 | — | — | EP | disclosed |