Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12258778 | 0.78 | PIK3CD (0.45) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL7897247 | 0.77 | PIK3CD (0.44) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL12029861 | 0.77 | PIK3CD (0.44) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL16644572 | 0.76 | GAA (0.47) | CYP1A2TDP1CYP2C9ALDH1A1KDM4E | |
| SCHEMBL584005 | 0.76 | CYP1A2 (0.46) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL26812142 | 0.76 | CYP1A2 (0.46) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL7919663 | 0.75 | EPHX2 (0.45) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL16639870 | 0.74 | USP2 (0.49) | ALDH1A1SMN1; SMN2USP2EPHX2MAPK1 | |
| Hydrochloric Acid SCHEMBL30747450 | 0.74 | CYP1A2 (0.44) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 | |
| SCHEMBL16887675 | 0.74 | CYP1A2 (0.44) | PIK3CDCYP1A2TDP1CYP2C9CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023098825-A1 | SOS1 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 勤浩医药（苏州）有限公司 | 2023-06-08 | — | — | WO | disclosed |