Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | KCNJ11 | Q14654 | 15/20 | 0.40 |
| ▸ | WDR5 | P61964 | 1/20 | 0.40 |
| ▸ | ABCC9 | O60706 | 6/20 | 0.39 |
| ▸ | ABCC8 | Q09428 | 6/20 | 0.39 |
| ▸ | KCNJ8 | Q15842 | 6/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2327971 | 0.85 | HPGD (0.46) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL15505858 | 0.76 | HSD17B10 (0.60) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL2328498 | 0.76 | HSD17B10 (0.59) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL3627335 | 0.74 | WDR5 (0.44) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL16384836 | 0.74 | HPGD (0.57) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL16384878 | 0.71 | HPGD (0.54) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL13856943 | 0.70 | HSD17B10 (1.00) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL11116162 | 0.70 | CYP1A2 (0.46) | CYP1A2CYP2D6CYP2C9CYP2C19HPGD | |
| SCHEMBL20436327 | 0.70 | ALDH1A1 (0.57) | CYP1A2HPGDHSD17B10KCNJ11WDR5 | |
| SCHEMBL2088436 | 0.69 | CETP (0.50) | HPGDWDR5ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010047318-A1 | HELICENE DERIVATIVE, AXIALLY ASYMMETRIC AMINO ACID, AMINE OR AMINOALCOHOL DERIVATIVE, PERYLENE DERIVATIVE OR SALT THEREOF, AND METHODS FOR PRODUCING SAME | 国立大学法人京都大学 (JP) | 2010-04-29 | — | — | WO | disclosed |