Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9982723 | 0.85 | C5AR1 (0.51) | C5AR1CYP3A4CYP2D6OPRM1ALDH1A1 | |
| SCHEMBL12067691 | 0.83 | C5AR1 (0.47) | C5AR1CYP3A4CYP2D6OPRM1ALDH1A1 | |
| SCHEMBL9982680 | 0.81 | C5AR1 (0.49) | C5AR1CYP3A4CYP2D6OPRM1ALDH1A1 | |
| SCHEMBL12069072 | 0.77 | C5AR1 (0.50) | C5AR1CYP3A4CYP2D6OPRM1ALDH1A1 | |
| SCHEMBL9982715 | 0.76 | C5AR1 (0.42) | C5AR1OPRM1ALDH1A1CHRM1CCR2 | |
| SCHEMBL12067255 | 0.75 | C5AR1 (0.49) | C5AR1CYP3A4CYP2D6OPRM1ALDH1A1 | |
| SCHEMBL9982742 | 0.73 | ALDH1A1 (0.51) | C5AR1CYP3A4CYP2D6ALDH1A1TSHR | |
| SCHEMBL12069182 | 0.73 | C5AR1 (0.45) | C5AR1CYP3A4CYP2D6OPRM1ALDH1A1 | |
| SCHEMBL9982630 | 0.73 | C5AR1 (0.56) | C5AR1OPRM1ALDH1A1TSHRCHRM1 | |
| SCHEMBL12069057 | 0.73 | C5AR1 (0.46) | C5AR1CYP3A4CYP2D6ALDH1A1KMT2A |
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-2582681-A1 | PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES | Novartis AG (CH) | 2013-04-24 | — | — | EP | disclosed |
| WO-2011157793-A1 | PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES | NOVARTIS AG (CH) | 2011-12-22 | — | — | WO | disclosed |