Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.46 |
| ▸ | LTB4R | Q15722 | 10/20 | 0.42 |
| ▸ | LTB4R2 | Q9NPC1 | 10/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | TACR2 | P21452 | 2/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL7809427 | 0.88 | TACR1 (0.52) | TACR1TACR2CYP3A4CYP2D6 | |
| SCHEMBL7811403 | 0.82 | TACR1 (0.46) | TACR1FNTAFNTBCYP3A4CYP2D6 | |
| SCHEMBL7815224 | 0.81 | ALDH1A1 (0.52) | TACR1TACR2FNTAFNTBCYP3A4 | |
| SCHEMBL7809340 | 0.78 | TACR1 (0.51) | TACR1FFAR1 | |
| SCHEMBL7811404 | 0.78 | TACR1 (0.49) | TACR1TACR2CYP3A4CYP2D6 | |
| SCHEMBL1532918 | 0.78 | PRKCZ (0.54) | FNTAFNTBCYP3A4CYP2D6PRKCZ | |
| SCHEMBL6975177 | 0.77 | MEN1 (0.51) | TACR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7815209 | 0.77 | TACR1 (0.50) | TACR1TACR2CYP3A4CYP2D6 | |
| SCHEMBL7815520 | 0.76 | TACR1 (0.60) | TACR1FNTAFNTBFFAR1 | |
| SCHEMBL7809430 | 0.76 | PLAAT3 (0.50) | TACR1FNTAFNTB |
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 |