Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.36 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23744213 | 0.81 | ALDH1A1 (0.41) | ALDH1A1HPGDCYP1A2 | |
| SCHEMBL8763411 | 0.80 | CYP1A1 (0.41) | ALDH1A1HPGDTSHRCYP1A2 | |
| SCHEMBL9127974 | 0.75 | MAOB (0.54) | ALDH1A1HPGDHTTSMN1; SMN2KDM4E | |
| SCHEMBL19418127 | 0.75 | IDO1 (0.50) | KMT2ALMNATDP1MEN1THRB | |
| SCHEMBL1199895 | 0.75 | LMNA (0.48) | KMT2ALMNATDP1MEN1THRB | |
| SCHEMBL12317473 | 0.75 | KMT2A (0.48) | KMT2ALMNATDP1MEN1THRB | |
| SCHEMBL3694280 | 0.75 | KMT2A (0.48) | KMT2ALMNATDP1MEN1THRB | |
| SCHEMBL8763247 | 0.74 | CYP1A1 (0.37) | CYP1A2 | |
| SCHEMBL1200922 | 0.72 | LMNA (0.44) | KMT2ALMNATDP1MEN1THRB | |
| SCHEMBL1200712 | 0.72 | SMN1; SMN2 (0.50) | KMT2ALMNATDP1MEN1THRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022188825-A1 | XYLYLENE DIISOCYNATE COMPOSITION, PREPARATION METHOD THEREFOR AND USE THEREOF | 万华化学集团股份有限公司 | 2022-09-15 | — | — | WO | disclosed |