Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 5/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | GBA1 | P04062 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL20043089 | 0.87 | P2RX7 (0.52) | P2RX7PKMABL1BCR | |
| SCHEMBL20042755 | 0.86 | GRM5 (0.43) | P2RX7GBA1MEN1KMT2AABL1 | |
| SCHEMBL20042704 | 0.85 | P2RX7 (0.50) | P2RX7KCNH2CNR2GBA1MEN1 | |
| SCHEMBL20042652 | 0.82 | P2RX7 (0.66) | P2RX7MEN1KMT2AABL1BCR | |
| SCHEMBL20042776 | 0.82 | P2RX7 (0.41) | P2RX7CNR2GBA1MEN1KMT2A | |
| SCHEMBL20042685 | 0.82 | HTT (0.42) | P2RX7KCNH2GBA1CYP1A2CYP2C9 | |
| SCHEMBL20042817 | 0.82 | PKM (0.44) | P2RX7PKMGBA1MEN1KMT2A | |
| SCHEMBL20042705 | 0.81 | EPHX2 (0.45) | P2RX7HRH3 | |
| SCHEMBL20042751 | 0.80 | HSD17B10 (0.49) | P2RX7KCNH2GBA1MEN1KMT2A | |
| SCHEMBL20042769 | 0.80 | P2RX7 (0.38) | P2RX7CNR2GBA1MEN1KMT2A |
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 |