Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CASR | P41180 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4763766 | 0.90 | NPC1 (0.55) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL13728113 | 0.88 | ACP1 (0.47) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL28034150 | 0.85 | NPC1 (0.44) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL13728690 | 0.84 | SQOR (0.47) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL1536512 | 0.84 | NPC1 (0.57) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL1536441 | 0.83 | PDGFRB (0.47) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL1536364 | 0.82 | APP (0.48) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL13728133 | 0.82 | NPC1 (0.44) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL13729085 | 0.82 | KDM4E (0.47) | NPC1RAB9ACASP3SENP7KDM4E | |
| SCHEMBL8191159 | 0.81 | DHODH (0.46) | NPC1RAB9ACASP3SENP7KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-104918941-A | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2015-09-16 | — | — | CN | disclosed |