Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHKA | P35790 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
| ▸ | CDC42BPB | Q9Y5S2 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16536746 | 1.00 | MAPT (0.50) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL25584599 | 0.98 | MAPT (0.47) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL10642814 | 0.92 | MAPT (0.48) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL21599156 | 0.92 | ROCK2 (0.53) | MAPTROCK2CYP3A4ROCK1CDC42BPB | |
| SCHEMBL25584616 | 0.87 | CYP3A4 (0.56) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL16525706 | 0.83 | CHRNB2 (0.55) | ROCK2ROCK1CDC42BPB | |
| SCHEMBL30040793 | 0.81 | ADRB1 (0.58) | MAPT | |
| SCHEMBL1632622 | 0.81 | PIK3CA (0.49) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL1631742 | 0.81 | ADRB1 (0.58) | MAPT | |
| SCHEMBL16525700 | 0.81 | AKT2 (0.45) | MAPTROCK2ROCK1CDC42BPB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114716426-A | Antiviral compounds | 詹森生物制药有限公司 | 2022-07-08 | — | — | CN | claimed |
| CN-107922427-B | Antiviral compounds | 詹森生物制药有限公司 | 2022-01-28 | — | — | CN | claimed |