Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 1.00 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 1.00 |
| ▸ | CRHBP | P24387 | 1/20 | 0.52 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.52 |
| ▸ | S100A4 | P26447 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PTPRC | P08575 | 1/20 | 0.50 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MGAM | O43451 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | SI | P14410 | 1/20 | 0.47 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28038982 | 1.00 | ALDH1A1 (1.00) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| SCHEMBL44392 | 1.00 | ALDH1A1 (1.00) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| Water SCHEMBL1828402 | 0.98 | ALDH1A1 (0.96) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| Biphenyl SCHEMBL7209601 | 0.98 | ALDH1A1 (0.96) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| Methane SCHEMBL2186810 | 0.98 | ALDH1A1 (0.96) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| Water SCHEMBL2045405 | 0.98 | ALDH1A1 (0.96) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| Hydrogen Sulfide SCHEMBL9671158 | 0.98 | ALDH1A1 (0.96) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| SCHEMBL29180134 | 0.96 | ALDH1A1 (0.92) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| SCHEMBL2958562 | 0.96 | ALDH1A1 (0.92) | ALDH1A1TDP1CRHBPCRHR2S100A4 | |
| Formaldehyde SCHEMBL28138834 | 0.96 | ALDH1A1 (0.92) | ALDH1A1TDP1CRHBPCRHR2S100A4 |
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-115715285-A | Compounds as UBR box domain ligands | 奧土择破利悟 | 2023-02-24 | — | — | CN | disclosed |