Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.38 |
| ▸ | BRS3 | P32247 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6948942 | 0.89 | BRD4 (0.50) | PARP1BRD4CREBBPNPC1RAB9A | |
| SCHEMBL6949839 | 0.86 | CHEK1 (0.50) | PARP1BRD4CREBBPNPC1RAB9A | |
| SCHEMBL6946473 | 0.84 | NPC1 (0.50) | PARP1BRD4CREBBPNPC1RAB9A | |
| SCHEMBL6946452 | 0.83 | NPC1 (0.42) | BRD4CREBBPNPC1RAB9AHDAC6 | |
| SCHEMBL6948419 | 0.81 | PARP1 (0.45) | PARP1BRD4CREBBPNPC1RAB9A | |
| SCHEMBL7649489 | 0.79 | NPC1 (0.41) | PARP1BRD4CREBBPNPC1RAB9A | |
| SCHEMBL6945364 | 0.79 | RAB9A (0.52) | PARP1BRD4CREBBPNPC1RAB9A | |
| SCHEMBL6948954 | 0.79 | NPC1 (0.55) | PARP1NPC1RAB9AHDAC6DHODH | |
| SCHEMBL6948273 | 0.79 | DHODH (0.51) | PARP1BRD4CREBBPHDAC6DHODH | |
| SCHEMBL6945300 | 0.78 | CHEK1 (0.48) | PARP1BRD4CREBBPHDAC6NTRK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0936218-B1 | BENZIMIDAZOLE DERIVATIVES | MOCHIDA PHARM CO LTD (JP) | 2003-04-02 | — | — | EP | disclosed |
| US-6387938-B1 | Benzimidazole derivatives | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2002-05-14 | — | — | US | disclosed |
| EP-0936218-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1999-08-18 | — | — | EP | disclosed |