Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | PPP1CA | P62136 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.42 |
| ▸ | HBB | P68871 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16391122 | 1.00 | PIN1 (0.51) | PIN1KMT2AMEN1PPP1CAALDH1A1 | |
| SCHEMBL9945481 | 0.83 | PIN1 (0.47) | PIN1KMT2AMEN1ALDH1A1EGFR | |
| SCHEMBL30635854 | 0.83 | EGFR (0.47) | PIN1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4171567 | 0.83 | EGFR (0.47) | PIN1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL16706312 | 0.81 | POLB (0.53) | PIN1ALDH1A1EGFRCYP3A4POLB | |
| SCHEMBL4172984 | 0.81 | PIN1 (0.44) | PIN1ALDH1A1CYP1A2EGFRCYP3A4 | |
| SCHEMBL30672854 | 0.81 | POLB (0.53) | PIN1ALDH1A1EGFRCYP3A4POLB | |
| SCHEMBL30672838 | 0.79 | PIN1 (0.64) | PIN1KMT2AMEN1PPP1CAALDH1A1 | |
| SCHEMBL16370549 | 0.79 | PIN1 (0.64) | PIN1KMT2AMEN1PPP1CAALDH1A1 | |
| SCHEMBL4173344 | 0.77 | F10 (0.43) | PIN1EGFRPOLBMAOBMAPT |
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-117486865-A | Pyrimidine derivatives as kinase inhibitors | 艾森医药公司 | 2024-02-02 | — | — | CN | disclosed |
| CN-112592334-B | Pyrimidine derivatives as kinase inhibitors | 艾森医药公司 | 2023-10-27 | — | — | CN | disclosed |