Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.46 |
| ▸ | RAB9A | P51151 | 7/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | EDNRB | P24530 | 3/20 | 0.44 |
| ▸ | EDNRA | P25101 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALPG | P10696 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL1703670 | 0.89 | PKM (0.45) | PKMNPC1RAB9ASMN1; SMN2EDNRB | |
| SCHEMBL1704052 | 0.85 | ALDH1A1 (0.49) | PKMNPC1RAB9ASMN1; SMN2EDNRB | |
| SCHEMBL1703757 | 0.80 | HPGD (0.48) | NPC1RAB9ASMN1; SMN2EDNRAMAPT | |
| SCHEMBL1703824 | 0.78 | RAB9A (0.55) | PKMNPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL5790071 | 0.78 | KIT (0.48) | PKMNPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL17664660 | 0.75 | PKM (0.74) | PKMNPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL1704103 | 0.75 | RAB9A (0.60) | PKMNPC1RAB9ASMN1; SMN2EDNRB | |
| SCHEMBL1703373 | 0.73 | NPC1 (0.56) | PKMNPC1RAB9ASMN1; SMN2EDNRB | |
| SCHEMBL27496628 | 0.71 | EDNRA (0.58) | PKMNPC1RAB9ASMN1; SMN2EDNRB | |
| SCHEMBL17440276 | 0.70 | LMNA (0.35) | LMNAKDM4EALDH1A1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2441768-A1 | Thienopyrimidinones for treatment of inflammatory disorders and cancers | Eli Lilly & Co. (US) | 2012-04-18 | — | — | EP | disclosed |