Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 3/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL1513548 | 0.79 | SIGMAR1 (0.50) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL652087 | 0.79 | SIGMAR1 (0.57) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL2267923 | 0.76 | SIGMAR1 (0.51) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL2270695 | 0.76 | SIGMAR1 (0.47) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL1513275 | 0.75 | DRD2 (0.55) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL3266597 | 0.73 | SIGMAR1 (0.51) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL3107373 | 0.70 | DRD2 (0.42) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL4703446 | 0.70 | SIGMAR1 (0.48) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL8086598 | 0.69 | SIGMAR1 (0.46) | SIGMAR1DRD2OPRM1OPRD1OPRK1 | |
| SCHEMBL1660350 | 0.69 | SIGMAR1 (0.62) | SIGMAR1DRD2OPRM1HTR2CALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2477983-B1 | (4-PHENYL-PIPERIDIN-1-YL)-[5-1H-PYRAZOL-4YL)-THIOPHEN-3-YL]-METHANONE COMPOUNDS AND THEIR USE | UNIV EDINBURGH (GB) | 2015-04-15 | — | — | EP | disclosed |