Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KCNA3 | P22001 | 4/20 | 0.40 |
| ▸ | DRD1 | P21728 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.40 |
| ▸ | KCNA1 | Q09470 | 2/20 | 0.40 |
| ▸ | KCNA2 | P16389 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL15349084 | 1.00 | MAOB (0.50) | MAOBMAOATRPA1LMNAPDE5A | |
| SCHEMBL17224568 | 0.78 | MAOA (0.46) | MAOBMAOATRPA1DRD1CNR1 | |
| SCHEMBL21999457 | 0.77 | DRD1 (0.58) | TRPA1KCNA3DRD1ACHE | |
| SCHEMBL3372411 | 0.75 | MAOB (0.64) | MAOBMAOALMNAGAAL3MBTL1 | |
| SCHEMBL4275782 | 0.75 | PDE5A (0.51) | TRPA1LMNAPDE5AL3MBTL1CNR1 | |
| SCHEMBL24215198 | 0.74 | L3MBTL1 (0.53) | MAOBMAOALMNAPDE5AGAA | |
| SCHEMBL22131724 | 0.72 | LMNA (0.44) | LMNAPDE5AL3MBTL1CNR1ACHE | |
| SCHEMBL5497728 | 0.72 | MAOB (0.51) | MAOBMAOALMNAGAAL3MBTL1 | |
| SCHEMBL5501147 | 0.72 | MAPT (0.56) | MAOBMAOALMNAGAAL3MBTL1 | |
| SCHEMBL15348986 | 0.72 | CASP3 (0.49) | MAOBGAAL3MBTL1KCNA3CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108383858-B | Derivatives of imidazothiadiazoles and imidazopyrazines for the treatment of platelet aggregation | 百时美施贵宝公司 | 2024-09-20 | — | — | CN | disclosed |