Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 16/20 | 0.73 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL12001092 | 0.88 | ACACB (0.74) | ACACBADRB1ADRB3 | |
| SCHEMBL173489 | 0.84 | ACACB (1.00) | ACACB | |
| SCHEMBL12001282 | 0.84 | ACACB (0.76) | ACACB | |
| SCHEMBL12001264 | 0.83 | ACACB (0.77) | ACACB | |
| SCHEMBL12001090 | 0.80 | ACACB (0.77) | ACACB | |
| SCHEMBL12001654 | 0.80 | ACACB (0.70) | ACACB | |
| SCHEMBL10187494 | 0.80 | ACACB (0.65) | ACACB | |
| SCHEMBL12001094 | 0.79 | ACACB (0.72) | ACACB | |
| SCHEMBL12001315 | 0.79 | ACACB (0.59) | ACACB | |
| SCHEMBL9124054 | 0.78 | ACACB (0.83) | ACACB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012028676-A1 | NEW COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-03-08 | — | — | WO | disclosed |