Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4620583 | 1.00 | CA2 (0.47) | CA2MEN1KMT2AESR1GAA | |
| SCHEMBL4218710 | 0.89 | MEN1 (0.41) | CA2MEN1KMT2AESR1GAA | |
| SCHEMBL6629103 | 0.85 | CA2 (0.44) | CA2MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL4622281 | 0.85 | CA2 (0.44) | CA2MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL4620614 | 0.82 | DRD2 (0.43) | CA2MEN1KMT2AESR1GAA | |
| SCHEMBL4619378 | 0.82 | DRD2 (0.43) | CA2MEN1KMT2AESR1GAA | |
| SCHEMBL4621894 | 0.82 | DRD2 (0.43) | CA2MEN1KMT2AESR1GAA | |
| SCHEMBL30170903 | 0.82 | DRD2 (0.43) | CA2MEN1KMT2AESR1GAA | |
| SCHEMBL4621704 | 0.81 | CA2 (0.43) | CA2MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL4621993 | 0.81 | CA2 (0.43) | CA2MEN1KMT2AGAAALDH1A1 |
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-4114523-A1 | HETEROCYCLIC DERIVATIVES AS TRMP8 ANTAGONISTS | Givaudan SA (CH) | 2023-01-11 | — | — | EP | disclosed |