Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1D2 | Q14995 | 1/20 | 0.32 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | EED | O75530 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28002206 | 0.75 | HRH3 (0.45) | — | |
| SCHEMBL3422418 | 0.74 | IDO1 (0.33) | OPRM1OPRD1OPRK1 | |
| SCHEMBL3420727 | 0.74 | IDO1 (0.33) | OPRM1OPRD1OPRK1 | |
| SCHEMBL3420730 | 0.74 | IDO1 (0.33) | OPRM1OPRD1OPRK1 | |
| SCHEMBL6301061 | 0.74 | CEL (0.37) | ITK | |
| SCHEMBL3419399 | 0.73 | GRM2 (0.31) | — | |
| SCHEMBL3916364 | 0.72 | GBA1 (0.41) | GBA1 | |
| SCHEMBL12241635 | 0.72 | CNR1 (0.47) | — | |
| SCHEMBL4283436 | 0.70 | ALDH1A1 (0.47) | NR1D2 | |
| SCHEMBL1663639 | 0.70 | CA1 (0.41) | — |
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-2638042-A1 | PIPERIDINONE CARBOXAMIDE AZAINDANE CGRP RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012064910-A1 | PIPERIDINONE CARBOXAMIDE AZAINDANE CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2012-05-18 | — | — | WO | disclosed |