Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4740444 | 0.90 | HCAR2 (0.34) | TP53ALDH1A1LDHA | |
| SCHEMBL4734328 | 0.89 | CCNC (0.32) | TP53ALDH1A1LDHA | |
| SCHEMBL4737057 | 0.89 | OPRL1 (0.36) | RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL4738895 | 0.87 | KMT2A (0.36) | NPC1RAB9AALDH1A1 | |
| SCHEMBL4735029 | 0.87 | NPY5R (0.33) | NPY5RTP53ALDH1A1LDHA | |
| SCHEMBL4739802 | 0.87 | NPC1 (0.32) | NPC1RAB9ATP53SMN1; SMN2 | |
| SCHEMBL4737642 | 0.86 | NPY5R (0.37) | NPY5RNPC1RAB9AALDH1A1 | |
| SCHEMBL4738064 | 0.85 | AVPR1A (0.34) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL4737821 | 0.85 | CYP26A1 (0.39) | — | |
| SCHEMBL4783797 | 0.84 | RORC (0.38) | TP53ALDH1A1 |
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-2008071765-A1 | PHARMACEUTICALLY ACTIVE SPIRO-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | NYCOMED GMBH (DE) | 2008-06-19 | — | — | WO | claimed |