Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TACR3 | P29371 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7811353 | 0.91 | MEN1 (0.46) | MAOBSMN1; SMN2MEN1KMT2A | |
| SCHEMBL7807793 | 0.86 | TACR1 (0.42) | TACR1HSP90AA1MAOBMAOAALDH1A1 | |
| SCHEMBL7815213 | 0.84 | HPGD (0.48) | TACR1HSP90AA1PNMTMEN1KMT2A | |
| SCHEMBL7807547 | 0.83 | KDM4E (0.44) | HSP90AA1ALDH1A1HTTCDK8CLK4 | |
| SCHEMBL6973686 | 0.82 | MEN1 (0.50) | CDK8CLK4MEN1KMT2ATACR3 | |
| SCHEMBL7802970 | 0.82 | TACR1 (0.50) | TACR1 | |
| SCHEMBL7815381 | 0.81 | KMT2A (0.41) | HSP90AA1MAOBMAOACDK8CLK4 | |
| SCHEMBL7802956 | 0.79 | TSHR (0.49) | TACR1ALDH1A1HTTSMN1; SMN2TSHR | |
| SCHEMBL7809519 | 0.77 | MEN1 (0.45) | MAOBSMN1; SMN2MEN1KMT2ATACR3 | |
| SCHEMBL7815536 | 0.76 | SIGMAR1 (0.43) | CDK8CLK4PNMTMEN1KMT2A |
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 |