Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HPGD | P15428 | 7/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30601308 | 0.88 | ALOX15 (0.38) | KDM4EALDH1A1HPGDLMNACYP1A2 | |
| SCHEMBL30601281 | 0.88 | ALOX15 (0.38) | KDM4EALDH1A1HPGDLMNACYP1A2 | |
| SCHEMBL30601258 | 0.85 | GAA (0.39) | KDM4EALDH1A1HPGDRAB9AHSD17B10 | |
| SCHEMBL17782060 | 0.85 | GAA (0.39) | KDM4EALDH1A1HPGDRAB9AHSD17B10 | |
| SCHEMBL1536712 | 0.82 | MAPT (0.53) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL1536623 | 0.74 | SMN1; SMN2 (0.53) | KDM4EALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL30601271 | 0.74 | ASPH (0.44) | KDM4EALDH1A1GAALMNATSHR | |
| SCHEMBL30601237 | 0.74 | KMT2A (0.38) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL27224134 | 0.72 | ALOX15 (0.38) | KDM4EALDH1A1HPGDMAPTRAB9A | |
| SCHEMBL1536744 | 0.72 | MAPT (0.53) | KDM4EALDH1A1HPGDMAPTNPC1 |
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-116514816-A | Pyrimidinone pyrrole derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2023-08-01 | — | — | CN | disclosed |