Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | CRHBP | P24387 | 1/20 | 0.67 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.67 |
| ▸ | GFER | P55789 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | LIG1 | P18858 | 1/20 | 0.56 |
| ▸ | GRK2 | P25098 | 1/20 | 0.56 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.56 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.56 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.56 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| P-Toluenesulfonamide SCHEMBL29272927 | 0.91 | ALDH1A1 (0.68) | ALDH1A1CRHBPCRHR2GFERKMT2A | |
| SCHEMBL7843167 | 0.87 | GFER (0.80) | ALDH1A1GFERKMT2ALMNAMAPT | |
| P-Toluenesulfonamide SCHEMBL29272935 | 0.80 | ALDH1A1 (0.65) | ALDH1A1CRHBPCRHR2KMT2APOLB | |
| SCHEMBL7853851 | 0.79 | MAPT (0.66) | ALDH1A1GFERKMT2ALMNAPOLB | |
| SCHEMBL7852879 | 0.79 | GFER (0.84) | ALDH1A1GFERKMT2ALMNAMAPT | |
| SCHEMBL12009647 | 0.78 | GFER (1.00) | ALDH1A1CRHBPCRHR2GFERKMT2A | |
| SCHEMBL22501081 | 0.78 | KMT2A (0.63) | KMT2A | |
| SCHEMBL22501083 | 0.78 | KMT2A (0.63) | KMT2A | |
| SCHEMBL7850949 | 0.77 | GFER (0.80) | ALDH1A1CRHBPCRHR2GFERKMT2A | |
| SCHEMBL7846928 | 0.77 | GFER (0.80) | ALDH1A1GFERKMT2AMAPTGAA |
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-113874361-B | Compound with anticancer activity and preparation method thereof | 医药生命融合研究团 | 2024-07-12 | — | — | CN | disclosed |