Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11291674 | 0.80 | TDP1 (0.55) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL11449040 | 0.78 | CYP1A2 (0.53) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL3529665 | 0.77 | TDP1 (0.52) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL9341301 | 0.75 | TDP1 (0.58) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| Iodide SCHEMBL29037976 | 0.75 | TDP1 (0.61) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| Hydrochloric Acid SCHEMBL28192676 | 0.75 | TDP1 (0.61) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL5852468 | 0.74 | CYP1A2 (0.56) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL9728093 | 0.74 | CYP1A2 (0.56) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL10790597 | 0.74 | CYP2D6 (0.59) | CYP2D6CYP2C19CYP1A2LMNAKMT2A | |
| SCHEMBL697267 | 0.73 | KMT2A (0.49) | CYP2D6CYP2C19CYP1A2LMNAKMT2A |
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-0064820-A1 | Substituted imidazole and imidazoline derivatives and their preparation and use | Farmos-Yhtyma Oy (FI) | 1982-11-17 | — | — | EP | disclosed |