Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.60 |
| ▸ | HSP90AB1 | P08238 | 7/20 | 0.60 |
| ▸ | GSK3B | P49841 | 8/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.48 |
| ▸ | HTR1B | P28222 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | UQCRB | P14927 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28296623 | 0.90 | HSP90AA1 (0.60) | HSP90AA1HSP90AB1GSK3BMEN1MAPT | |
| SCHEMBL29763714 | 0.85 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1ALDH1A1MEN1MAPT | |
| SCHEMBL29763707 | 0.82 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1LMNAHTTSMN1; SMN2 | |
| SCHEMBL29763713 | 0.81 | HSP90AA1 (0.62) | HSP90AA1HSP90AB1HTR1AHTR6ALDH1A1 | |
| SCHEMBL28296621 | 0.81 | HSP90AA1 (0.62) | HSP90AA1HSP90AB1HTR1AHTR6ALDH1A1 | |
| SCHEMBL29763705 | 0.80 | HSP90AA1 (0.67) | HSP90AA1HSP90AB1ALDH1A1MAPTLMNA | |
| SCHEMBL29763721 | 0.78 | HSP90AA1 (0.69) | HSP90AA1HSP90AB1MEN1KMT2ALMNA | |
| SCHEMBL29763722 | 0.75 | HSP90AA1 (0.74) | HSP90AA1HSP90AB1MEN1MAPTKMT2A | |
| SCHEMBL29763700 | 0.75 | HSP90AA1 (0.74) | HSP90AA1HSP90AB1 | |
| SCHEMBL812679 | 0.72 | ALDH1A1 (0.83) | ALDH1A1MEN1CYP1A2CYP3A4MAPT |
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-109761909-B | N- (4- (pyrimidine-4-amino) phenyl) sulfonamide inhibitor or pharmaceutically acceptable salt thereof, and preparation method and application thereof | 中国药科大学 | 2022-08-26 | — | — | CN | disclosed |