Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 11/20 | 0.86 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8936576 | 0.93 | TACR1 (1.00) | TACR1MEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL8936527 | 0.92 | TACR1 (0.90) | TACR1MEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL8936574 | 0.88 | TACR1 (0.83) | TACR1RXFP1MAPTMEN1KMT2A | |
| SCHEMBL8936481 | 0.88 | TACR1 (0.86) | TACR1MEN1KMT2ATP53NPC1 | |
| SCHEMBL8936577 | 0.88 | TACR1 (0.76) | TACR1MAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL8936410 | 0.87 | TACR1 (0.72) | TACR1ALDH1A1NPC1RAB9A | |
| SCHEMBL8936536 | 0.87 | TACR1 (0.77) | TACR1NPC1RAB9A | |
| SCHEMBL8936460 | 0.86 | TACR1 (0.76) | TACR1MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL8936542 | 0.86 | TACR1 (0.86) | TACR1KMT2AALDH1A1POLBNPC1 | |
| SCHEMBL8936439 | 0.86 | TACR1 (0.86) | TACR1RXFP1MAPTMEN1KMT2A |
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 |