Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.68 |
| ▸ | CES1 | P23141 | 2/20 | 0.68 |
| ▸ | PARP1 | P09874 | 1/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.59 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA6 | P23280 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | KMO | O15229 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL13950378 | 0.98 | CES2 (0.71) | CES2CES1PARP1L3MBTL1HDAC1 | |
| SCHEMBL28396 | 0.98 | CES2 (0.71) | CES2CES1PARP1L3MBTL1HDAC1 | |
| SCHEMBL29665004 | 0.98 | CES2 (0.71) | CES2CES1PARP1L3MBTL1HDAC1 | |
| Hydrochloric Acid SCHEMBL30596526 | 0.95 | CES2 (0.68) | CES2CES1PARP1L3MBTL1HDAC1 | |
| Hydrochloric Acid SCHEMBL5777634 | 0.95 | CES2 (0.68) | CES2CES1PARP1L3MBTL1HDAC1 | |
| SCHEMBL11459100 | 0.95 | CES2 (0.68) | CES2CES1PARP1L3MBTL1HDAC1 | |
| SCHEMBL28208655 | 0.95 | CES2 (0.68) | CES2CES1PARP1L3MBTL1HDAC1 | |
| Water SCHEMBL10357175 | 0.93 | CES2 (0.65) | CES2CES1PARP1L3MBTL1HDAC1 | |
| Methyl Alcohol SCHEMBL27893546 | 0.93 | CES2 (0.65) | CES2CES1PARP1L3MBTL1HDAC1 | |
| SCHEMBL15268423 | 0.91 | CES2 (0.63) | CES2CES1PARP1L3MBTL1HDAC1 |
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-117956992-A | MENIN-MLL interaction inhibitors | 赛达克斯制药股份有限公司 | 2024-04-30 | — | — | CN | disclosed |