Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | GBA1 | P04062 | 2/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SMO | Q99835 | 2/20 | 0.41 |
| ▸ | MTHFD2 | P13995 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042817 | 0.90 | PKM (0.44) | P2RX7GBA1HPGDMEN1KMT2A | |
| SCHEMBL20042668 | 0.89 | HPGD (0.51) | P2RX7GBA1HPGDMEN1KMT2A | |
| SCHEMBL20042685 | 0.88 | HTT (0.42) | P2RX7GBA1L3MBTL1SMN1; SMN2HTT | |
| SCHEMBL20042751 | 0.88 | HSD17B10 (0.49) | P2RX7GBA1HPGDMEN1KMT2A | |
| SCHEMBL20042832 | 0.88 | CFTR (0.45) | P2RX7CFTRHPGDMEN1KMT2A | |
| SCHEMBL20042771 | 0.87 | P2RX7 (0.47) | P2RX7HPGDMEN1KMT2AL3MBTL1 | |
| SCHEMBL20042684 | 0.87 | SMN1; SMN2 (0.52) | P2RX7HPGDALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL20042776 | 0.86 | P2RX7 (0.41) | P2RX7CNR1CNR2GPR55GBA1 | |
| SCHEMBL20042743 | 0.85 | P2RX7 (0.40) | P2RX7CNR1CNR2GPR55GBA1 | |
| SCHEMBL20042728 | 0.85 | MEN1 (0.42) | GBA1MEN1KMT2AL3MBTL1ALDH1A1 |
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 |