Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 8/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 8/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30451063 | 0.93 | ALDH1A1 (0.40) | ALDH1A1OPRK1KDM4EHKDC1HCRTR1 | |
| SCHEMBL30451183 | 0.85 | TSHR (0.39) | ALDH1A1KDM4EHCRTR1HCRTR2MAPT | |
| SCHEMBL23985111 | 0.85 | MAPT (0.43) | ALDH1A1KDM4EHCRTR1HCRTR2MAPT | |
| SCHEMBL30305409 | 0.85 | MAPT (0.43) | ALDH1A1KDM4EHCRTR1HCRTR2MAPT | |
| SCHEMBL30305511 | 0.84 | MAPT (0.42) | ALDH1A1KDM4EHKDC1HCRTR1HCRTR2 | |
| SCHEMBL23985885 | 0.83 | MAPT (0.42) | ALDH1A1KDM4EHCRTR1HCRTR2MAPT | |
| SCHEMBL30305504 | 0.83 | MAPT (0.42) | ALDH1A1KDM4EHCRTR1HCRTR2MAPT | |
| SCHEMBL23985120 | 0.81 | TNIK (0.39) | ALDH1A1MAPTHSD17B10 | |
| SCHEMBL30305463 | 0.81 | TNIK (0.39) | ALDH1A1MAPTHSD17B10 | |
| SCHEMBL25408630 | 0.79 | MAPT (0.41) | ALDH1A1KDM4EHKDC1HCRTR1HCRTR2 |
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-116261562-A | PI 3K-alpha inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-06-13 | — | — | CN | disclosed |