Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7653156 | 0.94 | ALDH1A1 (0.42) | ALDH1A1KDM4ENPC1RAB9ACHEK1 | |
| SCHEMBL6945277 | 0.90 | CHEK1 (0.48) | ALDH1A1KDM4ENPC1RAB9ACHEK1 | |
| SCHEMBL29828622 | 0.90 | CHEK1 (0.48) | ALDH1A1KDM4ENPC1RAB9ACHEK1 | |
| SCHEMBL7650912 | 0.86 | NPC1 (0.40) | KDM4ENPC1RAB9ACHEK1BRD4 | |
| SCHEMBL6952443 | 0.86 | BRD4 (0.46) | ALDH1A1KDM4ENPC1RAB9ACHEK1 | |
| SCHEMBL7654851 | 0.85 | ALDH1A1 (0.50) | ALDH1A1KDM4ENPC1RAB9AGAA | |
| SCHEMBL7656006 | 0.84 | KDM4E (0.42) | ALDH1A1KDM4ENPC1RAB9ACHEK1 | |
| SCHEMBL7657249 | 0.83 | NPC1 (0.39) | NPC1RAB9ACHEK1BRD4CREBBP | |
| SCHEMBL7649489 | 0.83 | NPC1 (0.41) | NPC1RAB9ACHEK1BRD4CREBBP | |
| SCHEMBL6948766 | 0.82 | CHEK1 (0.47) | ALDH1A1KDM4ECHEK1MAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-6387938-B1 | Benzimidazole derivatives | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2002-05-14 | — | — | US | disclosed |