Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 13/20 | 0.44 |
| ▸ | INSR | P06213 | 3/20 | 0.39 |
| ▸ | IGF1R | P08069 | 3/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18812797 | 1.00 | PIN1 (0.44) | PIN1INSRIGF1RALKALDH1A1 | |
| SCHEMBL30183986 | 0.81 | KDM4E (0.37) | PIN1INSRIGF1RALKALDH1A1 | |
| SCHEMBL29172306 | 0.81 | KDM4E (0.37) | PIN1INSRIGF1RALKALDH1A1 | |
| SCHEMBL30875700 | 0.79 | PIN1 (0.43) | PIN1ALDH1A1 | |
| SCHEMBL29172293 | 0.79 | PIN1 (0.43) | PIN1ALDH1A1 | |
| SCHEMBL25947633 | 0.77 | PIN1 (0.46) | PIN1ALDH1A1HTT | |
| SCHEMBL30378947 | 0.76 | LCK (0.46) | PIN1ALDH1A1HTT | |
| SCHEMBL30635855 | 0.76 | PIN1 (0.64) | PIN1ALDH1A1HTT | |
| SCHEMBL3334570 | 0.76 | PIN1 (0.64) | PIN1ALDH1A1HTT | |
| SCHEMBL26087125 | 0.76 | LCK (0.46) | PIN1ALDH1A1HTT |
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-117730083-A | Pyrimidine compounds as MAP4K1 inhibitors | 格兰马克专业公司 | 2024-03-19 | — | — | CN | disclosed |