Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 10/20 | 0.74 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.67 |
| ▸ | PLAU | P00749 | 1/20 | 0.66 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.66 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.61 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL6450749 | 0.91 | NPBWR1 (0.71) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL27765862 | 0.88 | CHEK2 (0.78) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL3178116 | 0.88 | CHEK2 (0.78) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL19753931 | 0.86 | CHEK2 (0.67) | CHEK2NPBWR1NR4A2MEN1KMT2A | |
| SCHEMBL2243148 | 0.85 | CHEK2 (0.80) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL2649653 | 0.85 | HDAC6 (0.76) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL2617479 | 0.85 | KDM4E (0.71) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL18237054 | 0.83 | HDAC6 (0.95) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL19986735 | 0.82 | CYP1A2 (0.59) | CHEK2HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL13808897 | 0.82 | HDAC6 (0.74) | CHEK2HDAC3HDAC1HDAC8HDAC6 |
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 |