Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 14/20 | 0.56 |
| ▸ | ACACA | Q13085 | 11/20 | 0.56 |
| ▸ | CKS1B | P61024 | 1/20 | 0.42 |
| ▸ | SKP1 | P63208 | 1/20 | 0.42 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.42 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.41 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.40 |
| ▸ | TTK | P33981 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL8866482 | 0.93 | ACACB (0.47) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL8867021 | 0.90 | ACACB (0.50) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL8867046 | 0.87 | ACACB (0.45) | ACACBACACAIRAK1TTK | |
| SCHEMBL8866085 | 0.86 | ACACB (0.54) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL8866425 | 0.85 | ACACB (0.42) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL9233943 | 0.84 | ACACB (0.41) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL4589317 | 0.83 | ACACB (0.46) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL8866814 | 0.80 | ACACB (0.49) | ACACBACACAIRAK1CYP1A2CYP3A4 | |
| SCHEMBL8866469 | 0.78 | ACACB (0.46) | ACACBACACACKS1BSKP1SKP2 | |
| SCHEMBL8866617 | 0.77 | ACACB (0.51) | ACACBACACACKS1BSKP1SKP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5614531-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-03-25 | — | — | US | disclosed |