Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | TACR2 | P21452 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7809427 | 0.87 | TACR1 (0.52) | TACR1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7809517 | 0.87 | TACR1 (0.47) | TACR1LMNAKMT2AMEN1TDP1 | |
| SCHEMBL7815209 | 0.85 | TACR1 (0.50) | TACR1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7807790 | 0.85 | TACR1 (0.55) | TACR1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7807768 | 0.84 | TACR1 (0.44) | TACR1LMNAKMT2AMEN1TDP1 | |
| SCHEMBL7811404 | 0.84 | TACR1 (0.49) | TACR1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6969734 | 0.84 | ALDH1A1 (0.49) | TACR1CYP3A4CYP2D6KMT2AMEN1 | |
| SCHEMBL6961996 | 0.83 | MEN1 (0.47) | TACR1CYP3A4CYP2D6KMT2AMEN1 | |
| SCHEMBL8801314 | 0.81 | HPGD (0.45) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8801310 | 0.81 | HPGD (0.45) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0773929-B1 | PIPERIDINE DERIVATIVES AS NEUROKININ ANTAGONISTS | SCHERING CORP (US) | 2001-10-31 | — | — | EP | disclosed |
| US-5654316-A | Piperidine derivatives as neurokinin antagonists | SCHERING CORPORATION (US) | 1997-08-05 | — | — | US | disclosed |