Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 4/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | AKT1 | P31749 | 2/20 | 0.38 |
| ▸ | AKT2 | P31751 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19970801 | 0.87 | CHEK2 (0.43) | DRD4SIGMAR1DRD3TMEM97CHEK2 | |
| SCHEMBL19982579 | 0.85 | SLC2A1 (0.44) | SLC2A1NPBWR1KCNH2DGAT1 | |
| SCHEMBL23843058 | 0.83 | CHEK2 (0.43) | DRD4SIGMAR1DRD3TMEM97CHEK2 | |
| SCHEMBL19986769 | 0.81 | DRD4 (0.45) | DRD4SIGMAR1DRD3TMEM97CHEK2 | |
| SCHEMBL19970747 | 0.81 | DRD4 (0.45) | DRD4SIGMAR1DRD3TMEM97CHEK2 | |
| SCHEMBL19982612 | 0.79 | CYP1A2 (0.43) | DRD4SIGMAR1DRD3TMEM97SLC2A1 | |
| SCHEMBL19982584 | 0.79 | CHEK2 (0.46) | CHEK2BCHEACHEDGAT1 | |
| SCHEMBL19970874 | 0.79 | CHEK2 (0.46) | CHEK2BCHEACHEDGAT1 | |
| SCHEMBL19970866 | 0.78 | CHEK2 (0.47) | CHEK2BCHEACHE | |
| SCHEMBL19970820 | 0.78 | DRD4 (0.43) | DRD4SIGMAR1DRD3TMEM97CHEK2 |
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-2018050771-A1 | BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2018-03-22 | — | — | WO | disclosed |