Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 3/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6194153 | 0.75 | SMN1; SMN2 (0.46) | ACACBSLC6A3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6194155 | 0.75 | SMN1; SMN2 (0.46) | ACACBSLC6A3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL31369505 | 0.74 | TDP1 (0.40) | ACACBSLC6A3RAB9ANPC1SLC6A2 | |
| SCHEMBL3355554 | 0.74 | NPC1 (0.39) | ACACBSLC6A3RAB9ANPC1SLC6A2 | |
| SCHEMBL9480 | 0.73 | PARP15 (0.43) | ACACBSLC6A3RAB9ANPC1SLC6A2 | |
| SCHEMBL13022782 | 0.72 | CYP3A4 (0.61) | TDP1CYP3A4 | |
| SCHEMBL13599560 | 0.72 | CYP3A4 (0.61) | TDP1CYP3A4 | |
| SCHEMBL6192176 | 0.72 | ACACB (0.45) | ACACBSLC6A3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6192171 | 0.72 | ACACB (0.45) | ACACBSLC6A3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2727900 | 0.71 | SLC7A5 (0.47) | SLC6A3TDP1CYP3A4 |
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-2001066534-A2 | CYCLIC AND BICYCLIC DIAMINO HISTAMINE-3 RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2001-09-13 | — | — | WO | disclosed |