Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 3/20 | 0.53 |
| ▸ | NOS3 | P29474 | 2/20 | 0.53 |
| ▸ | NOS1 | P29475 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 10/20 | 0.47 |
| ▸ | RAB9A | P51151 | 10/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.42 |
| ▸ | RELA | Q04206 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9569019 | 0.89 | NOS2 (0.53) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL9568978 | 0.88 | NOS2 (0.53) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL10334040 | 0.84 | NOS2 (0.57) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL9569061 | 0.82 | NOS2 (0.53) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL10333432 | 0.81 | NOS2 (0.56) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL10333548 | 0.78 | NOS2 (0.53) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL10333572 | 0.77 | NOS2 (0.48) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL9569066 | 0.76 | CCR1 (0.51) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL9538681 | 0.76 | PDE10A (0.45) | NOS2NOS3NOS1NPC1RAB9A | |
| SCHEMBL10333446 | 0.74 | NOS3 (0.51) | NOS2NOS3NOS1NPC1RAB9A |
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-0526033-A1 | Benzimidazoles | FISONS plc (GB) | 1993-02-03 | — | — | EP | disclosed |