Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 2/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | STAT5B | P51692 | 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 | |
|---|---|---|---|---|
| SCHEMBL26631541 | 1.00 | DHODH (0.38) | DHODHAKT1MCL1KDM4EALDH1A1 | |
| SCHEMBL28943154 | 0.92 | DHODH (0.47) | DHODHAKT1MCL1STAT5B | |
| SCHEMBL26631532 | 0.83 | CNR1 (0.35) | DHODHMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL30138973 | 0.83 | CNR1 (0.35) | DHODHMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL23925332 | 0.75 | RNASEH1 (0.50) | DHODHKDM4EALDH1A1HPGDCRHBP | |
| SCHEMBL16331805 | 0.71 | AKT1 (0.36) | AKT1MCL1HDAC3HDAC1HDAC2 | |
| SCHEMBL30138958 | 0.71 | ATR (0.43) | DHODHCACNA1BCACNA1C | |
| SCHEMBL20378076 | 0.71 | ATR (0.43) | DHODHCACNA1BCACNA1C | |
| SCHEMBL2473065 | 0.70 | TP53 (0.43) | AKT1MCL1 | |
| SCHEMBL14910299 | 0.69 | KDM4E (0.40) | AKT1MCL1KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-4136077-A1 | BENZIMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2023-02-22 | — | — | EP | disclosed |
| CN-115485266-A | Benzimidazole derivatives | 豪夫迈·罗氏有限公司 | 2022-12-16 | — | — | CN | disclosed |