Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.42 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.35 |
| ▸ | CDK9 | P50750 | 3/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.34 |
| ▸ | DBH | P09172 | 1/20 | 0.33 |
| ▸ | MC1R | Q01726 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3978850 | 0.89 | HSP90AA1 (0.43) | HSP90AA1HSP90B1POLBTHRBCDK9 | |
| SCHEMBL3984837 | 0.87 | HSP90AA1 (0.45) | HSP90AA1HSP90B1POLBTHRBOPRD1 | |
| SCHEMBL3980102 | 0.86 | HSP90AA1 (0.47) | HSP90AA1HSP90B1OPRD1OPRK1MC1R | |
| SCHEMBL3978717 | 0.85 | HSP90AA1 (0.46) | HSP90AA1HSP90B1POLBTHRBOPRD1 | |
| SCHEMBL3983750 | 0.84 | HSP90AA1 (0.43) | HSP90AA1HSP90B1POLBTHRBCDK9 | |
| SCHEMBL3982292 | 0.83 | CCNT1 (0.39) | HSP90AA1HSP90B1CDK9MEN1ALDH1A1 | |
| SCHEMBL3981483 | 0.83 | ALDH1A1 (0.41) | HSP90AA1HSP90B1POLBTHRBCDK9 | |
| SCHEMBL3983787 | 0.83 | HSP90AA1 (0.47) | HSP90AA1HSP90B1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL13720814 | 0.83 | HSP90AA1 (0.46) | HSP90AA1HSP90B1POLBTHRBCDK9 | |
| SCHEMBL3986911 | 0.81 | HSP90AA1 (0.46) | HSP90AA1HSP90B1OPRD1CDK9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7572921-B2 | Substituted benzylimidazoles useful for the treatment of inflammatory diseases | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-08-11 | — | — | US | disclosed |
| US-7572921-B2 | Substituted benzylimidazoles useful for the treatment of inflammatory diseases | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-08-11 | — | — | US | disclosed |