Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 8/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19954678 | 0.84 | TAAR1 (0.37) | TAAR1KIF11SIGMAR1KCNN4 | |
| SCHEMBL19954716 | 0.78 | TAAR1 (0.46) | TAAR1CYP2D6CYP1A2KIF11ALDH1A1 | |
| SCHEMBL19954746 | 0.78 | CHRM3 (0.34) | TAAR1KIF11SIGMAR1ALDH1A1 | |
| SCHEMBL19954762 | 0.72 | TAAR1 (0.38) | TAAR1RIPK1CYP2D6CYP1A2KIF11 | |
| SCHEMBL1538286 | 0.69 | KCNN4 (0.39) | TAAR1CYP2D6CYP1A2KIF11ALDH1A1 | |
| SCHEMBL30659516 | 0.68 | CYP2D6 (0.41) | RIPK1CYP2D6CYP1A2KIF11SIGMAR1 | |
| SCHEMBL1059898 | 0.68 | KCNN4 (0.48) | TAAR1ALDH1A1CYP2C19KCNN4 | |
| SCHEMBL19954758 | 0.67 | CNR2 (0.41) | TAAR1KIF11SIGMAR1KCNN4 | |
| SCHEMBL19954763 | 0.67 | KCNN4 (0.44) | TAAR1CYP2D6CYP1A2KIF11KCNN4 | |
| SCHEMBL19954691 | 0.67 | CYP2D6 (0.35) | TAAR1CYP2D6CYP1A2KIF11ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9917273-B2 | Cross-linking polymer and organic electroluminescent element using same | IDEMITSU KOSAN CO., LTD. (JP) | 2018-03-13 | — | — | US | disclosed |