Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 5/20 | 0.42 |
| ▸ | ABL1 | P00519 | 3/20 | 0.42 |
| ▸ | HCK | P08631 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | EPHA3 | P29320 | 1/20 | 0.41 |
| ▸ | CSK | P41240 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25715555 | 0.85 | SRC (0.41) | SRCABL1HCKLCKEGFR | |
| SCHEMBL25715609 | 0.81 | TNK2 (0.37) | SRCABL1LCKKDM4EALDH1A1 | |
| SCHEMBL25714867 | 0.79 | MAP4K4 (0.40) | SRCABL1LCKTNK2MAP4K4 | |
| SCHEMBL25715485 | 0.77 | CYP2C9 (0.45) | CYP1A2CYP3A4CYP2C9CYP2D6CYP2C19 | |
| SCHEMBL25715553 | 0.75 | CYP11B1 (0.45) | SRCABL1HCKLCKEGFR | |
| SCHEMBL25715556 | 0.75 | KDR (0.46) | SRCABL1LCKEGFRHSD17B1 | |
| SCHEMBL25715683 | 0.72 | HPGD (0.43) | SRCABL1LCKKDM4EALDH1A1 | |
| SCHEMBL25714215 | 0.69 | FGFR1 (0.34) | SRCABL1LCKTNK2 | |
| SCHEMBL25715804 | 0.68 | PIK3CD (0.31) | — | |
| SCHEMBL123357 | 0.64 | TNK2 (0.52) | SRCABL1EGFRTNK2MAP4K4 |
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-2023104035-A1 | SUBSTITUTED MONOCYCLIC OR BICYCLIC HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 英矽智能科技(上海)有限公司 | 2023-06-15 | — | — | WO | disclosed |