Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.54 |
| ▸ | RAB9A | P51151 | 6/20 | 0.54 |
| ▸ | PKM | P14618 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | METAP2 | P50579 | 9/20 | 0.51 |
| ▸ | METAP1 | P53582 | 7/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | MTOR | P42345 | 1/20 | 0.51 |
| ▸ | CBFB | Q13951 | 9/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16499527 | 0.92 | NPC1 (0.55) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL16498271 | 0.87 | NPC1 (0.63) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL16499392 | 0.85 | ALDH1A1 (0.51) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL13866553 | 0.84 | NPC1 (0.74) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL10351277 | 0.80 | NPC1 (0.68) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL16499516 | 0.76 | ALDH1A1 (0.53) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL16497806 | 0.76 | KDM4E (0.51) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL13866538 | 0.76 | NPC1 (0.74) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL12708878 | 0.75 | CBFB (0.64) | NPC1RAB9APKMSMN1; SMN2KDM4E | |
| SCHEMBL5396521 | 0.74 | KDM4E (0.50) | NPC1RAB9APKMSMN1; SMN2KDM4E |
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-2011151619-A1 | COMPOUNDS FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE ASSOCIATED DISEASE | SUMMIT CORPORATION PLC (GB) | 2011-12-08 | — | — | WO | claimed |