Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | UNG | P13051 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.38 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 3/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | PGK1 | P00558 | 1/20 | 0.36 |
| ▸ | PGK2 | P07205 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2263076 | 1.00 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL7141606 | 0.83 | ALDH1A1 (0.45) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL30291836 | 0.83 | TYR (0.56) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL727874 | 0.83 | TYR (0.56) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL2536000 | 0.82 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6SRCDRD1 | |
| SCHEMBL29756201 | 0.79 | ALDH1A1 (0.50) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL4950119 | 0.78 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL4952311 | 0.78 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL4808239 | 0.78 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6TYRSRC | |
| SCHEMBL2937253 | 0.78 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6TYRSRC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113382767-B | Urea compounds having substituents | 第一三共株式会社 | 2024-12-24 | — | — | CN | disclosed |
| CN-118724903-A | Compound with fused ring structure, its preparation method and use, and pharmaceutical composition and use | 苏州安赛隆医药科技有限公司 | 2024-10-01 | — | — | CN | disclosed |