Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR39 | O43194 | 1/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 10/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 8/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15356477 | 0.78 | KIT (0.50) | FAAHCYP1A2HSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL15473169 | 0.78 | HRH4 (0.42) | GPR39HRH4HRH3FAAHCYP1A2 | |
| SCHEMBL16664924 | 0.76 | HRH4 (0.41) | HRH4HRH3 | |
| SCHEMBL22838698 | 0.73 | SYK (0.42) | CYP1A2HSD17B10CYP3A4ALDH1A1CLK4 | |
| SCHEMBL19905207 | 0.73 | CYP1A2 (0.51) | CYP1A2HSD17B10CYP3A4ALDH1A1CLK4 | |
| SCHEMBL16664969 | 0.72 | KDM4E (0.47) | FAAHCYP1A2HSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL15343048 | 0.72 | KDM4E (0.47) | FAAHCYP1A2HSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL22838542 | 0.72 | LRRK2 (0.41) | FAAHCYP1A2HSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL22838720 | 0.72 | CYP1A2 (0.46) | CYP1A2HSD17B10CYP3A4ALDH1A1CLK4 | |
| SCHEMBL28017373 | 0.71 | ABL1 (0.55) | CYP1A2HSD17B10CYP3A4CLK4CYP2D6 |
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-2015058031-A1 | DNA-PK INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-04-23 | — | — | WO | disclosed |