Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.32 |
| ▸ | LTA4H | P09960 | 2/20 | 0.31 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29858030 | 1.00 | LMNA (0.38) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL6030679 | 0.75 | LMNA (0.44) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL16044116 | 0.75 | LMNA (0.44) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL16043880 | 0.75 | LMNA (0.44) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL2578991 | 0.74 | LMNA (0.38) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL8889467 | 0.74 | PLAU (0.41) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL28824731 | 0.72 | MAPK1 (0.46) | LMNASMN1; SMN2PLAUMAPK1L3MBTL1 | |
| SCHEMBL29858081 | 0.72 | MAPK1 (0.46) | LMNASMN1; SMN2PLAUMAPK1L3MBTL1 | |
| SCHEMBL11522882 | 0.71 | LMNA (0.45) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 | |
| SCHEMBL22719038 | 0.70 | SMN1; SMN2 (0.38) | LMNACYP2C9TSHRAPEX1SMN1; SMN2 |
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-109776427-B | Pyrimidine diamine compound and application thereof | 沈阳中化农药化工研发有限公司 | 2022-08-23 | — | — | CN | disclosed |