Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 6/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | RET | P07949 | 2/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | PI4KA | P42356 | 2/20 | 0.35 |
| ▸ | XDH | P47989 | 2/20 | 0.35 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1598149 | 0.81 | CHEK1 (0.66) | CHEK1NOTUMAKT1TRPA1LRRK2 | |
| SCHEMBL31329069 | 0.81 | CHEK1 (0.66) | CHEK1NOTUMAKT1TRPA1LRRK2 | |
| SCHEMBL5805420 | 0.78 | RET (0.43) | CHEK1NOTUMRETLRRK2CDK2 | |
| SCHEMBL21620551 | 0.78 | CHEK1 (0.47) | CHEK1NOTUMAKT1TRPA1LRRK2 | |
| SCHEMBL6531144 | 0.77 | RET (0.42) | CHEK1TRPA1RETLRRK2BRAF | |
| SCHEMBL30052782 | 0.77 | RET (0.42) | CHEK1TRPA1RETLRRK2BRAF | |
| SCHEMBL12590783 | 0.76 | NOTUM (0.56) | CHEK1NOTUMAKT1TRPA1LRRK2 | |
| SCHEMBL10259826 | 0.75 | AKT1 (0.45) | CHEK1AKT1TRPA1RETBRAF | |
| SCHEMBL397485 | 0.75 | CHEK1 (0.63) | CHEK1TRPA1RETLRRK2CDK2 | |
| SCHEMBL868756 | 0.75 | RET (0.41) | CHEK1AKT1RETLRRK2CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3464249-B1 | SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS | PFIZER (US) | 2021-08-11 | — | — | EP | disclosed |