Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | PDE5A | O76074 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL24101792 | 0.84 | RAB9A (0.54) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 | |
| SCHEMBL24101795 | 0.82 | SMN1; SMN2 (0.62) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 | |
| SCHEMBL24101794 | 0.81 | ALDH1A1 (0.59) | LCKALDH1A1SMN1; SMN2TP53RAB9A | |
| SCHEMBL24101796 | 0.78 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 | |
| SCHEMBL24101943 | 0.75 | NPC1 (0.56) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 | |
| SCHEMBL24101410 | 0.72 | MEN1 (0.61) | ALDH1A1SMN1; SMN2RAB9ANPC1POLB | |
| SCHEMBL16607172 | 0.69 | SMN1; SMN2 (0.64) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 | |
| SCHEMBL772812 | 0.68 | LCK (1.00) | LCKALDH1A1SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL24101413 | 0.68 | PDE5A (0.53) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 | |
| SCHEMBL3585075 | 0.66 | SMN1; SMN2 (1.00) | ALDH1A1SMN1; SMN2TP53RAB9ANPC1 |
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 |