Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 14/20 | 1.00 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8936527 | 0.95 | TACR1 (0.90) | TACR1SMN1; SMN2KDM4EMEN1ALDH1A1 | |
| SCHEMBL8936542 | 0.93 | TACR1 (0.86) | TACR1SMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL8936454 | 0.93 | TACR1 (0.86) | TACR1MEN1ALDH1A1CYP2C19KMT2A | |
| SCHEMBL8936439 | 0.93 | TACR1 (0.86) | TACR1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL8936481 | 0.93 | TACR1 (0.86) | TACR1SMN1; SMN2KDM4EMEN1HPGD | |
| SCHEMBL8936574 | 0.91 | TACR1 (0.83) | TACR1KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL8936543 | 0.89 | TACR1 (0.80) | TACR1MEN1ALDH1A1KMT2A | |
| SCHEMBL8936580 | 0.89 | TACR1 (0.80) | TACR1MEN1ALDH1A1KMT2A | |
| SCHEMBL8936598 | 0.88 | TACR1 (0.78) | TACR1 | |
| SCHEMBL8936536 | 0.87 | TACR1 (0.77) | TACR1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5523305-A | ANALGESICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-06-04 | — | — | US | disclosed |
| EP-0566069-A1 | Tachykinin receptor antagonists, isoquinolones and their production | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-10-20 | — | — | EP | disclosed |