Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | GFER | P55789 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8684539 | 0.86 | MEN1 (0.69) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL8347824 | 0.85 | MEN1 (0.68) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL12963486 | 0.82 | MEN1 (0.73) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL12862549 | 0.81 | ALDH1A1 (0.74) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL1544971 | 0.81 | MEN1 (0.71) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL12933330 | 0.81 | MEN1 (0.62) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL31037456 | 0.81 | MEN1 (0.71) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL3828558 | 0.81 | TSHR (0.83) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL9378094 | 0.80 | MEN1 (0.61) | MEN1KMT2ATSHRKDM4EGAA | |
| SCHEMBL5748764 | 0.80 | MEN1 (1.00) | MEN1KMT2ATSHRKDM4EGAA |
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-4992550-A | Thymidylate synthetase inhibitors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-02-12 | — | — | US | disclosed |
| EP-0373891-A2 | Anti-tumour agents | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-06-20 | — | — | EP | disclosed |
| EP-0239362-A2 | Anti-tumor agents | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-09-30 | — | — | EP | disclosed |