Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 9/20 | 0.66 |
| ▸ | F2 | P00734 | 3/20 | 0.64 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.64 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.64 |
| ▸ | TMPRSS6 | Q8IU80 | 3/20 | 0.64 |
| ▸ | ST14 | Q9Y5Y6 | 3/20 | 0.64 |
| ▸ | KLK1 | P06870 | 1/20 | 0.46 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL3872851 | 0.85 | PRSS1 (0.60) | PRSS1F2PRSS2PRSS3TMPRSS6 | |
| SCHEMBL3875680 | 0.83 | PRSS1 (0.84) | PRSS1F2PRSS2PRSS3TMPRSS6 | |
| SCHEMBL3667557 | 0.80 | PRSS1 (0.72) | PRSS1F2PRSS2PRSS3TMPRSS6 | |
| SCHEMBL3869914 | 0.80 | PRSS1 (0.57) | PRSS1F2PRSS2PRSS3TMPRSS6 | |
| SCHEMBL5524345 | 0.80 | PRSS1 (1.00) | PRSS1F2PRSS2PRSS3TMPRSS6 | |
| SCHEMBL17515720 | 0.78 | PRSS1 (0.75) | PRSS1F2PRSS2PRSS3TMPRSS6 | |
| SCHEMBL4135587 | 0.77 | LMNA (0.51) | LMNACYP1A2MAOACNR1DRD4 | |
| SCHEMBL3689477 | 0.77 | LMNA (0.51) | LMNACYP1A2MAOACNR1DRD4 | |
| Hydrochloric Acid SCHEMBL5071263 | 0.76 | LMNA (0.52) | LMNACYP1A2MAOACNR1DRD4 | |
| SCHEMBL6318640 | 0.76 | HRH3 (0.46) | LMNACYP1A2MAOACNR1DRD4 |
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-2018054989-A1 | BENZOIMIDAZOLE DERIVATIVES AS ANTICANCER AGENTS | CENTRE LEON BERARD (FR) | 2018-03-29 | — | — | WO | disclosed |