Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 19/20 | 0.52 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | ACACA | Q13085 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL533013 | 0.83 | ACLY (0.53) | ACLYACACBACACAMEN1KMT2A | |
| SCHEMBL532938 | 0.83 | ACLY (0.55) | ACLYACACBACACAMEN1KMT2A | |
| SCHEMBL8313576 | 0.81 | ACLY (0.52) | ACLYACACBACACAMEN1KMT2A | |
| SCHEMBL533484 | 0.79 | ACLY (0.58) | ACLYACACBACACA | |
| SCHEMBL533973 | 0.78 | ACLY (0.61) | ACLYMEN1CYP3A4KMT2AHSD17B10 | |
| SCHEMBL533474 | 0.76 | ACLY (0.57) | ACLYACACBACACAMEN1KMT2A | |
| SCHEMBL532990 | 0.71 | ACLY (0.59) | ACLY | |
| SCHEMBL532777 | 0.70 | ACLY (0.74) | ACLY | |
| SCHEMBL5568477 | 0.69 | ACLY (0.39) | ACLYACACBACACAMEN1KMT2A | |
| SCHEMBL21930999 | 0.69 | ACLY (1.00) | ACLYACACBACACAMEN1KMT2A |
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-2415760-A2 | CCR-9 antagonists | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2012-02-08 | — | — | EP | disclosed |