Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 8/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | CPN1 | P15169 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.32 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.32 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.32 |
| ▸ | MC4R | P32245 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.30 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.30 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6586743 | 0.84 | CPN1 (0.32) | CPN1CPB2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6584546 | 0.82 | SLC6A2 (0.35) | CPN1CPB2GNAI3GNAO1GNAI1 | |
| Hydrochloric Acid SCHEMBL5413829 | 0.81 | OPRD1 (0.54) | OPRD1OPRM1OPRK1MC4RSIGMAR1 | |
| SCHEMBL6585188 | 0.79 | CPN1 (0.34) | CPN1CPB2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6585899 | 0.77 | SLC6A3 (0.43) | CPN1CPB2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6586012 | 0.77 | SMYD3 (0.32) | CPN1CPB2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6587799 | 0.75 | SLC6A2 (0.31) | CPN1CPB2GNAI3GNAO1GNAI1 | |
| SCHEMBL6584321 | 0.74 | — | — | |
| SCHEMBL6584313 | 0.74 | DPP4 (0.37) | CPN1CPB2CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL6586715 | 0.73 | CA2 (0.38) | CACNA2D1CACNA1BCACNB1 |
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-6294555-B1 | SEROTONIN HT3 RECEPTOR ANTAGONIST FOR GASTROINTESTINAL DISORDERS | DAINIPPON PHARMACEUTICAL CO., LTD. (JP) | 2001-09-25 | — | — | US | disclosed |
| EP-1076055-A1 | 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS | Dainippon Pharmaceutical Co., Ltd. (JP) | 2001-02-14 | — | — | EP | disclosed |