Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 8/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3978561 | 0.84 | RORC (0.38) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3975405 | 0.77 | GRIN2B (0.44) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3976891 | 0.76 | RORC (0.50) | RORCCYP2D6CYP2C9CYP2C19GRIN2B | |
| SCHEMBL3975897 | 0.73 | GRIN2B (0.43) | RORCCYP2D6CYP3A4GRIN2BCYP1A2 | |
| SCHEMBL4188990 | 0.72 | CYP2D6 (0.44) | CYP2D6CYP3A4OPRK1 | |
| SCHEMBL3977469 | 0.71 | RORC (0.36) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3983521 | 0.71 | RORC (0.36) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3976532 | 0.71 | ALDH1A1 (0.38) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3979106 | 0.71 | RORC (0.36) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3976644 | 0.70 | ALDH1A1 (0.36) | RORCCYP2D6CYP3A4CYP2C9CYP2C19 |
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-1882689-A1 | TRI- OR TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVES | Daiichi Sankyo Company, Limited (JP) | 2008-01-30 | — | — | EP | disclosed |