Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 10/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 4/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.40 |
| ▸ | ROS1 | P08922 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3817001 | 0.99 | DPP4 (0.45) | DPP4CYP3A4CNR1CNR2PIK3CA | |
| SCHEMBL3822442 | 0.88 | PIK3CA (0.41) | DPP4CNR1CNR2PIK3CAPIK3CB | |
| SCHEMBL19835882 | 0.79 | MALT1 (0.49) | DPP4MEN1KMT2A | |
| SCHEMBL3821670 | 0.78 | DPP4 (0.46) | DPP4CYP3A4CNR1CNR2KMT2A | |
| Hydrochloric Acid SCHEMBL3819328 | 0.77 | DPP4 (0.46) | DPP4CYP3A4CNR1CNR2KMT2A | |
| SCHEMBL3822527 | 0.76 | CNR1 (0.47) | CNR1 | |
| SCHEMBL3819116 | 0.76 | PGR (0.46) | CYP3A4CNR1 | |
| SCHEMBL4802881 | 0.75 | KMT2A (0.61) | DPP4CNR1CNR2MEN1KMT2A | |
| SCHEMBL14207824 | 0.74 | CNR1 (0.52) | CNR1CNR2 | |
| SCHEMBL32670439 | 0.73 | AHR (0.57) | PIK3CAPIK3CBPIK3CG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1937672-B1 | N-[(4,5-DIPHENYLPYRIMIDIN-2-YL)METHYL]AMINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR THERAPEUTIC USE | SANOFI AVENTIS (FR) | 2009-09-02 | — | — | EP | disclosed |
| EP-1937672-A1 | N-[(4,5-DIPHENYLPYRIMIDIN-2-YL)METHYL]AMINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR THERAPEUTIC USE | Sanofi-Aventis (FR) | 2008-07-02 | — | — | EP | disclosed |
| WO-2007006928-A1 | N-[(4,5-DIPHENYLPYRIMIDIN-2-YL)METHYL]AMINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR THERAPEUTIC USE | SANOFI-AVENTIS (FR) | 2007-01-18 | — | — | WO | disclosed |