Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.34 |
| ▸ | CDK9 | P50750 | 2/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | ALPI | P09923 | 1/20 | 0.33 |
| ▸ | ALPG | P10696 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL2272271 | 0.76 | SIGMAR1 (0.47) | SIGMAR1DPP4DRD2HTR2CCCNT1 | |
| SCHEMBL1513381 | 0.76 | DRD2 (0.46) | SIGMAR1DPP4DRD2HTR2CCCNT1 | |
| SCHEMBL1513363 | 0.76 | SIGMAR1 (0.46) | SIGMAR1DPP4DRD2HTR2CCCNT1 | |
| SCHEMBL1513557 | 0.73 | DRD2 (0.46) | SIGMAR1DPP4DRD2HTR2CCCNT1 | |
| SCHEMBL6178145 | 0.73 | SIGMAR1 (0.68) | SIGMAR1DPP4DRD2HTR2CCCNT1 | |
| SCHEMBL2276233 | 0.71 | SIGMAR1 (0.42) | SIGMAR1DPP4DRD2HTR2CCCNT1 | |
| SCHEMBL10306210 | 0.71 | DRD2 (0.37) | SIGMAR1DRD2CYP2D6 | |
| SCHEMBL615480 | 0.68 | DRD2 (0.66) | SIGMAR1DRD2 | |
| SCHEMBL4702499 | 0.67 | DRD2 (0.47) | SIGMAR1DPP4DRD2CYP2D6 | |
| SCHEMBL3108178 | 0.67 | CCNT1 (0.40) | SIGMAR1DPP4DRD2HTR2CCCNT1 |
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 |