Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.34 |
| ▸ | GBA1 | P04062 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.33 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.33 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042674 | 0.89 | P2RX7 (0.37) | P2RX7HCAR2CFTRMEN1KMT2A | |
| SCHEMBL20042832 | 0.86 | CFTR (0.45) | P2RX7CFTRMEN1KMT2AHPGD | |
| SCHEMBL20042668 | 0.84 | HPGD (0.51) | P2RX7MEN1KMT2AHPGDGBA1 | |
| SCHEMBL20042776 | 0.84 | P2RX7 (0.41) | P2RX7HCAR2CFTRMEN1KMT2A | |
| SCHEMBL20042817 | 0.84 | PKM (0.44) | P2RX7MEN1KMT2AHPGDGBA1 | |
| SCHEMBL20042743 | 0.84 | P2RX7 (0.40) | P2RX7HPGDGBA1KDM4ETSHR | |
| SCHEMBL20042854 | 0.83 | GRM5 (0.42) | P2RX7MEN1KMT2AHPGDHSP90AA1 | |
| SCHEMBL20042756 | 0.83 | P2RX7 (0.38) | P2RX7MEN1KMT2AHSP90AA1GBA1 | |
| SCHEMBL20042755 | 0.82 | GRM5 (0.43) | P2RX7MEN1KMT2AHPGDGBA1 | |
| SCHEMBL20042689 | 0.82 | P2RX7 (0.39) | P2RX7HSP90AA1GBA1CNR2CASP1 |
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 |