Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADK | P55263 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 5/20 | 0.40 |
| ▸ | SRC | P12931 | 5/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 3/20 | 0.35 |
| ▸ | KDR | P35968 | 3/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | HCK | P08631 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 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 | |
|---|---|---|---|---|
| SCHEMBL24651179 | 0.83 | ADK (0.44) | ADKEGFRSRCCDK1LRRK2 | |
| SCHEMBL463027 | 0.75 | ADK (0.48) | ADKEGFRSRCCDK1LRRK2 | |
| SCHEMBL23735270 | 0.74 | ADK (0.47) | ADKEGFRSRCCDK1LRRK2 | |
| SCHEMBL19304156 | 0.71 | SRC (0.62) | ADKEGFRSRCKDM4EHTT | |
| SCHEMBL2618932 | 0.71 | PIK3CD (0.52) | ADKSRCKDRPI4KBPIK3CD | |
| SCHEMBL18599138 | 0.71 | EGFR (0.39) | EGFRSRCLRRK2KDM4EHTT | |
| SCHEMBL24072614 | 0.69 | SRC (0.54) | ADKEGFRSRCCDK1LRRK2 | |
| SCHEMBL24072104 | 0.69 | RIPK2 (0.61) | ADKEGFRSRCLRRK2ABL1 | |
| SCHEMBL14643108 | 0.68 | ADK (0.42) | ADKEGFRSRCCDK1KDM4E | |
| SCHEMBL26831072 | 0.68 | RPS6KB1 (0.47) | ADKEGFRSRCCDK1ABL1 |
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-2022109551-A1 | SRC INHIBITORS AND USES THEREOF | RELAY THERAPEUTICS, INC. (US) | 2022-05-27 | — | — | WO | disclosed |