Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 7/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTR1F | P30939 | 1/20 | 0.44 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.44 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.44 |
| ▸ | TCF7L2 | Q9NQB0 | 2/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.43 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14784010 | 1.00 | HDAC3 (0.57) | HDAC3HDAC2MAPTHTR1FKCNQ3 | |
| SCHEMBL29591540 | 0.93 | HDAC3 (0.53) | HDAC3HDAC2MAPTHDAC1CTNNB1 | |
| SCHEMBL14783300 | 0.93 | HDAC3 (0.55) | HDAC3HDAC2MAPTKCNQ3KCNQ2 | |
| SCHEMBL14783333 | 0.93 | HDAC3 (0.53) | HDAC3HDAC2MAPTHDAC1CTNNB1 | |
| SCHEMBL29590918 | 0.93 | HDAC3 (0.55) | HDAC3HDAC2MAPTKCNQ3KCNQ2 | |
| SCHEMBL29590491 | 0.92 | HDAC3 (0.56) | HDAC3HDAC2MAPTKCNQ3KCNQ2 | |
| SCHEMBL14783789 | 0.92 | HDAC3 (0.56) | HDAC3HDAC2MAPTKCNQ3KCNQ2 | |
| SCHEMBL29591622 | 0.90 | KCNQ3 (0.55) | HDAC3HDAC2MAPTHTR1FKCNQ3 | |
| SCHEMBL14783318 | 0.90 | KCNQ3 (0.55) | HDAC3HDAC2MAPTHTR1FKCNQ3 | |
| SCHEMBL29591582 | 0.89 | HDAC3 (0.52) | HDAC3HDAC2KCNQ3KCNQ2HDAC1 |
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-115403531-A | Chemical entities, compositions, and methods as kinase inhibitors | 润新生物公司 | 2022-11-29 | — | — | CN | disclosed |
| CN-108794411-B | Certain chemical entities, compositions, and methods | 润新生物公司 | 2022-06-07 | — | — | CN | disclosed |