Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | HTT | P42858 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.44 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6264474 | 0.83 | RAB9A (0.48) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL6271501 | 0.83 | POLB (0.44) | NPC1ALDH1A1HTTSMN1; SMN2KDM4E | |
| SCHEMBL6264555 | 0.82 | MEN1 (0.42) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL3981602 | 0.80 | ALDH1A1 (0.48) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL6271790 | 0.79 | ALDH1A1 (0.40) | NPC1ALDH1A1HTTSMN1; SMN2NCOA1 | |
| SCHEMBL6267239 | 0.76 | CA1 (0.43) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL6270554 | 0.75 | MEN1 (0.40) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL6266974 | 0.75 | ALDH1A1 (0.46) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL6269443 | 0.73 | SMN1; SMN2 (0.41) | NPC1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL10603799 | 0.73 | NPC1 (0.57) | NPC1ALDH1A1HTTSMN1; SMN2GAA |
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-2005095366-A1 | 7-ARYL 1,5-DIHYDRO-4,1-BENZOXAZEPIN-2(3H)-ONE DERIVATIVES AND THEIR USE AS PROGESTERONE RECEPTOR MODULATORS | WYETH (US) | 2005-10-13 | — | — | WO | disclosed |