Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 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 | |
|---|---|---|---|---|
| SCHEMBL5897147 | 0.76 | HSD17B10 (0.48) | TDP1 | |
| SCHEMBL251109 | 0.74 | LMNA (0.53) | HTTTDP1 | |
| SCHEMBL544668 | 0.74 | SMAD3 (0.41) | HTT | |
| SCHEMBL11436852 | 0.74 | PIN1 (0.59) | HTTHSP90AA1ESR2TDP1PIN1 | |
| SCHEMBL3715874 | 0.71 | NPC1 (0.42) | — | |
| SCHEMBL11096785 | 0.69 | TDP1 (0.35) | MCHR1HTTHSP90AA1ESR2TDP1 | |
| SCHEMBL830501 | 0.69 | KDM4E (0.34) | HTTTDP1 | |
| SCHEMBL3388847 | 0.69 | ALDH1A1 (0.65) | HTT | |
| SCHEMBL4279399 | 0.69 | HPGD (0.51) | HTT | |
| SCHEMBL11118273 | 0.68 | LMNA (0.57) | MCHR1HSP90AA1ESR2TDP1PIN1 |
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-2432779-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | Exelixis, Inc. (US) | 2012-03-28 | — | — | EP | disclosed |