Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CCNK | O75909 | 1/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24101687 | 0.78 | LCK (0.52) | ALDH1A1HPGDPOLBRAB9ATP53 | |
| SCHEMBL24101794 | 0.76 | ALDH1A1 (0.59) | ALDH1A1HPGDPOLBRAB9ATP53 | |
| SCHEMBL24101791 | 0.76 | LMNA (0.56) | ALDH1A1L3MBTL1CCNKDDB1CDK12 | |
| SCHEMBL24101416 | 0.76 | GAA (0.66) | ALDH1A1HPGDPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL24101792 | 0.75 | RAB9A (0.54) | ALDH1A1HPGDPOLBL3MBTL1RAB9A | |
| SCHEMBL24101795 | 0.75 | SMN1; SMN2 (0.62) | ALDH1A1HPGDRAB9ATP53SMN1; SMN2 | |
| SCHEMBL24101407 | 0.72 | CCNK (0.51) | ALDH1A1HPGDPOLBL3MBTL1CCNK | |
| SCHEMBL24101802 | 0.71 | SLC12A2 (0.51) | ALDH1A1HPGDPOLBL3MBTL1CCNK | |
| SCHEMBL24101413 | 0.65 | PDE5A (0.53) | ALDH1A1HPGDPOLBL3MBTL1CCNK | |
| SCHEMBL24101688 | 0.62 | NPC1 (0.68) | ALDH1A1POLBCCNKDDB1CDK12 |
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-2021249517-A1 | A MOLECULAR GLUE REGULATING CDK12-DDB1 INTERACTION TO TRIGGER CYCLIN K DEGRADATION | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2021-12-16 | — | — | WO | disclosed |