Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 8/20 | 0.51 |
| ▸ | MTOR | P42345 | 7/20 | 0.51 |
| ▸ | PIK3CD | O00329 | 7/20 | 0.51 |
| ▸ | EGFR | P00533 | 4/20 | 0.51 |
| ▸ | PRKDC | P78527 | 3/20 | 0.51 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 5/20 | 0.45 |
| ▸ | AXL | P30530 | 1/20 | 0.45 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | FLT1 | P17948 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29133741 | 0.88 | EGFR (0.66) | PIK3CAMTORPIK3CDEGFRPRKDC | |
| SCHEMBL29133717 | 0.88 | EGFR (0.50) | PIK3CAMTORPIK3CDEGFRPRKDC | |
| SCHEMBL29133709 | 0.84 | EGFR (0.49) | PIK3CAEGFRPRKDCCDK8ABL1 | |
| SCHEMBL29133702 | 0.84 | EGFR (0.49) | PIK3CAMTORPIK3CDEGFRPRKDC | |
| SCHEMBL29133761 | 0.83 | EGFR (0.51) | PIK3CAEGFRPRKDCCDK8ABL1 | |
| SCHEMBL29133731 | 0.82 | EGFR (0.63) | PIK3CAEGFRPRKDCCDK8ABL1 | |
| SCHEMBL29133738 | 0.81 | CCNC (0.47) | PIK3CAEGFRPRKDCCDK8ABL1 | |
| SCHEMBL29133770 | 0.80 | PIK3CA (0.54) | PIK3CAMTORPIK3CDEGFRPRKDC | |
| SCHEMBL29133767 | 0.80 | EGFR (0.44) | PIK3CAEGFRPRKDCCDK8ABL1 | |
| SCHEMBL29133710 | 0.80 | CYP1A2 (0.52) | EGFRPRKDCCDK8ABL1SRC |
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-117295716-A | Substituted aminobenzyl heteroaryl compounds as EGFR and/or PI3K inhibitors | 麦克尼斯迪克治疗有限公司 | 2023-12-26 | — | — | CN | disclosed |