Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 1/20 | 0.51 |
| ▸ | TDO2 | P48775 | 1/20 | 0.51 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.49 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.45 |
| ▸ | NSD2 | O96028 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28118455 | 0.88 | PTK2 (0.54) | PTK2PIK3CDPIK3CGKMT2ACYP1A2 | |
| SCHEMBL28294579 | 0.87 | KMO (0.52) | TDO2PIK3CDPIK3CGGAA | |
| SCHEMBL30338494 | 0.81 | PTK2 (0.57) | PTK2PIK3CDPIK3CGKMT2ACYP1A2 | |
| SCHEMBL82675 | 0.80 | HCAR3 (0.68) | PTK2KMT2ACYP1A2GAAHCAR3 | |
| SCHEMBL10195598 | 0.78 | PTK2 (0.57) | PTK2TDO2PIK3CDPIK3CGKMT2A | |
| SCHEMBL17317003 | 0.76 | TDO2 (0.58) | PTK2TDO2PIK3CDPIK3CGKMT2A | |
| SCHEMBL22975369 | 0.76 | PTK2 (0.56) | PTK2TDO2PIK3CDPIK3CGKMT2A | |
| SCHEMBL22975368 | 0.76 | PTK2 (0.56) | PTK2TDO2PIK3CDPIK3CGKMT2A | |
| SCHEMBL17114304 | 0.75 | P4HA1 (0.59) | — | |
| SCHEMBL22575346 | 0.75 | CSNK2A1 (0.51) | PTK2TDO2PIK3CDPIK3CGCYP1A2 |
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-117049961-A | Yeast dehydrogenase inhibitor derivative and synthesis method thereof | 苏州君叶生物医药科技有限公司 | 2023-11-14 | — | — | CN | disclosed |