Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | UTS2R | Q9UKP6 | 13/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7129808 | 0.78 | MEN1 (0.34) | MEN1KMT2ASMN1; SMN2ALDH1A1CA12 | |
| SCHEMBL26894224 | 0.78 | — | — | |
| SCHEMBL13241298 | 0.76 | ACE (0.31) | — | |
| SCHEMBL24851498 | 0.76 | BLM (0.39) | MEN1KMT2AALDH1A1CA12CA1 | |
| SCHEMBL27459062 | 0.76 | MAPK1 (0.43) | MEN1KMT2ACA1CA2TSHR | |
| SCHEMBL9462411 | 0.76 | MAPK1 (0.43) | MEN1KMT2ACA1CA2TSHR | |
| SCHEMBL361526 | 0.73 | ALDH1A1 (0.40) | MEN1KMT2ASMN1; SMN2UTS2RALDH1A1 | |
| SCHEMBL5790691 | 0.73 | CHRNB2 (0.33) | — | |
| SCHEMBL1672355 | 0.73 | GABRR1 (0.52) | — | |
| SCHEMBL847328 | 0.73 | GABRR1 (0.52) | — |
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-3508204-A1 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | Neupharma, Inc. (US) | 2019-07-10 | — | — | EP | disclosed |