Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 3/20 | 0.32 |
| ▸ | CDK8 | P49336 | 3/20 | 0.32 |
| ▸ | HASPIN | Q8TF76 | 3/20 | 0.32 |
| ▸ | CDK19 | Q9BWU1 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 2/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.30 |
| ▸ | BACE1 | P56817 | 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 | 0.91 | HCAR2 (0.34) | ALDH1A1TP53LDHAPIN1 | |
| SCHEMBL4735029 | 0.89 | NPY5R (0.33) | ALDH1A1TP53LDHA | |
| SCHEMBL4784972 | 0.89 | NPY5R (0.33) | ALDH1A1TP53LDHA | |
| SCHEMBL4737642 | 0.87 | NPY5R (0.37) | ALDH1A1 | |
| SCHEMBL4738064 | 0.87 | AVPR1A (0.34) | ALDH1A1 | |
| SCHEMBL4783797 | 0.86 | RORC (0.38) | ALDH1A1TP53 | |
| SCHEMBL4739249 | 0.86 | PIN1 (0.31) | PIN1 | |
| SCHEMBL4737057 | 0.85 | OPRL1 (0.36) | ALDH1A1 | |
| SCHEMBL4738895 | 0.84 | KMT2A (0.36) | ALDH1A1 | |
| SCHEMBL4737821 | 0.81 | CYP26A1 (0.39) | — |
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 2 patents. 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 |
| WO-2008071765-A1 | PHARMACEUTICALLY ACTIVE SPIRO-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | NYCOMED GMBH (DE) | 2008-06-19 | — | — | WO | disclosed |