Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 8/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | ITK | Q08881 | 1/20 | 0.36 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11019171 | 0.82 | TDP1 (0.42) | ALDH1A1HPGDCHEK2KDM4E | |
| SCHEMBL11020861 | 0.80 | ATM (0.41) | ALDH1A1HPGDLMNACHEK2KDM4E | |
| SCHEMBL11017894 | 0.80 | CHEK2 (0.43) | ALDH1A1HPGDCHEK2HSP90AA1KDM4E | |
| SCHEMBL11016456 | 0.79 | CHEK2 (0.44) | CHEK2 | |
| SCHEMBL11019649 | 0.79 | RHEB (0.44) | ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL11017086 | 0.76 | DHFR (0.42) | ALDH1A1HPGDLMNACHEK2CNR2 | |
| SCHEMBL11019017 | 0.76 | HPSE (0.42) | ALDH1A1CHEK2 | |
| SCHEMBL10416651 | 0.75 | KDM4C (0.39) | ALDH1A1LMNAKDM4E | |
| SCHEMBL9307137 | 0.74 | HPGD (0.56) | ALDH1A1HPGDLMNACHEK2HSP90AA1 | |
| SCHEMBL11016884 | 0.73 | CHEK2 (0.41) | CHEK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0148431-A1 | Benzimidazoles, their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1985-07-17 | — | — | EP | disclosed |