Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | FABP3 | P05413 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | FABP4 | P15090 | 1/20 | 0.37 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30723302 | 0.92 | MEN1 (0.38) | CYP2C9FABP3FABP4FABP5ALDH1A1 | |
| SCHEMBL30723329 | 0.84 | ALDH1A1 (0.45) | CYP2C9ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL30723324 | 0.84 | KDM4E (0.38) | CYP2C9ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL30723305 | 0.82 | MAPT (0.40) | ALDH1A1KMT2AMEN1MAPTRAB9A | |
| SCHEMBL29152982 | 0.82 | HSD17B10 (0.45) | CYP2C9ALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL30723331 | 0.82 | KMT2A (0.34) | CYP2C9ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL30723322 | 0.78 | MAPT (0.36) | CYP2C9ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL30723307 | 0.78 | TRPV4 (0.44) | ALDH1A1KMT2AMEN1MAPTRAB9A | |
| SCHEMBL30723337 | 0.78 | KMT2A (0.36) | ALDH1A1KMT2AMEN1RAB9AKDM4E | |
| SCHEMBL30723314 | 0.78 | ACHE (0.54) | CYP2C9ALDH1A1KMT2AMEN1MAPT |
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-117486887-A | Polycyclic pyrimidine-4-ketone compound and preparation method and application thereof | 昆明学院 | 2024-02-02 | — | — | CN | disclosed |