Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 10/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | FOS | P01100 | 1/20 | 0.44 |
| ▸ | JUN | P05412 | 1/20 | 0.44 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 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 | |
|---|---|---|---|---|
| SCHEMBL18494035 | 0.81 | ACACB (0.51) | ACACBNR1H4MAPTMEN1ALOX12 | |
| SCHEMBL18494038 | 0.81 | ACACB (0.51) | ACACBNR1H4MAPTMEN1ALOX12 | |
| SCHEMBL23314141 | 0.80 | ACACB (0.50) | ACACBMAPTMEN1ALOX12KMT2A | |
| SCHEMBL13155583 | 0.79 | ACACB (0.53) | ACACBMAPTMEN1ALOX12KMT2A | |
| SCHEMBL7752956 | 0.78 | ACACB (0.55) | ACACB | |
| SCHEMBL18608209 | 0.78 | ACACB (0.52) | ACACBMAPTMEN1ALOX12KMT2A | |
| SCHEMBL7539052 | 0.76 | ITGB3 (0.61) | ACACBNR1H4MAPTMEN1ALOX12 | |
| SCHEMBL7539043 | 0.76 | ITGB3 (0.61) | ACACBNR1H4MAPTMEN1ALOX12 | |
| SCHEMBL20234627 | 0.76 | ACACB (0.49) | ACACBMAPTMEN1ALOX12KMT2A | |
| SCHEMBL246245 | 0.75 | PPARA (0.49) | ACACBLMNA |
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-2776409-B1 | MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS | ENSEMBLE THERAPEUTICS CORP (US) | 2016-02-03 | — | — | EP | disclosed |