Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 5/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | BCR | P11274 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | GBA1 | P04062 | 2/20 | 0.32 |
| ▸ | TACR3 | P29371 | 1/20 | 0.32 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | GPR55 | Q9Y2T6 | 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 | |
|---|---|---|---|---|
| SCHEMBL20042756 | 0.89 | P2RX7 (0.38) | P2RX7HSP90AA1MEN1KMT2AGBA1 | |
| SCHEMBL20042720 | 0.88 | GRM5 (0.41) | P2RX7HSP90AA1 | |
| SCHEMBL20042666 | 0.85 | KMT2A (0.46) | P2RX7MEN1KMT2AGBA1TACR3 | |
| SCHEMBL20042823 | 0.84 | P2RX7 (0.45) | P2RX7MEN1KMT2AGBA1TACR3 | |
| SCHEMBL20042829 | 0.84 | P2RX7 (0.41) | P2RX7GBA1TACR3KDM4ECNR1 | |
| SCHEMBL20042792 | 0.82 | TACR3 (0.46) | P2RX7MEN1KMT2ATACR3CNR1 | |
| SCHEMBL20042836 | 0.82 | P2RX7 (0.43) | P2RX7MEN1KMT2AGBA1TACR3 | |
| SCHEMBL20042755 | 0.82 | GRM5 (0.43) | P2RX7ABL1BCRMEN1KMT2A | |
| SCHEMBL20042873 | 0.82 | P2RX7 (0.38) | P2RX7HSP90AA1MEN1KMT2AGBA1 | |
| SCHEMBL20042685 | 0.81 | HTT (0.42) | P2RX7ABL1BCRGBA1TACR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |