Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | CRHBP | P24387 | 1/20 | 0.54 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8241650 | 0.87 | ALDH1A1 (0.85) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| SCHEMBL7848449 | 0.81 | MAPT (0.65) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| P-Toluenesulfonamide SCHEMBL29272949 | 0.80 | ALDH1A1 (0.68) | ALDH1A1MAPTGAACRHBPCRHR2 | |
| P-Toluenesulfonamide SCHEMBL29272927 | 0.80 | ALDH1A1 (0.68) | ALDH1A1MAPTGAACRHBPCRHR2 | |
| SCHEMBL23417935 | 0.80 | ALDH1A1 (1.00) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| SCHEMBL25609773 | 0.78 | MAPT (0.66) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| P-Toluenesulfonamide SCHEMBL29272950 | 0.77 | MAPT (0.59) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| SCHEMBL30674423 | 0.77 | MEN1 (0.65) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| SCHEMBL26708909 | 0.77 | MEN1 (0.65) | ALDH1A1L3MBTL1KDM4EMAPTGAA | |
| SCHEMBL7849756 | 0.76 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1KDM4EMAPTNR3C1 |
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-113874361-B | Compound with anticancer activity and preparation method thereof | 医药生命融合研究团 | 2024-07-12 | — | — | CN | claimed |
| 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 |