Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.39 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL30385669 | 0.87 | MEN1 (0.41) | KMT2AMEN1EGLN1SMN1; SMN2P2RY12 | |
| SCHEMBL24741567 | 0.84 | CHRM5 (0.41) | CHRM5CHRM1SMN1; SMN2P2RY12PTK2 | |
| SCHEMBL24742177 | 0.77 | HSD17B10 (0.39) | KMT2AMEN1SMN1; SMN2P2RY12HTR1A | |
| SCHEMBL24741566 | 0.75 | RAD52 (0.43) | KMT2AMEN1P2RY12MAPTDRD2 | |
| SCHEMBL24741852 | 0.74 | P2RY12 (0.37) | KMT2AMEN1P2RY12AOC3MAPT | |
| SCHEMBL24742172 | 0.73 | MAPK10 (0.38) | P2RY12DRD2DRD4DRD3 | |
| SCHEMBL24742059 | 0.72 | HSD17B10 (0.39) | KMT2AMEN1P2RY12HTR1AMAPT | |
| SCHEMBL24742749 | 0.72 | KMT2A (0.39) | KMT2AMEN1P2RY12AOC3L3MBTL1 | |
| SCHEMBL24741646 | 0.72 | MAPT (0.38) | P2RY12CYP2D6MAPTLMNACYP1A2 | |
| SCHEMBL24741627 | 0.72 | DRD2 (0.44) | HTR1ADRD2DRD4DRD3 |
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-113248427-B | Sulfonyl nicotinic acid derivative, amido nicotinic acid derivative, preparation method and application thereof | 苏州大学 | 2023-05-02 | — | — | CN | disclosed |