Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 13/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HCK | P08631 | 1/20 | 0.43 |
| ▸ | FGR | P09769 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | FLT4 | P35916 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.43 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.43 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 2/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21178778 | 0.82 | RET (0.77) | RETCYP1A2HCKFGRRPS6KB1 | |
| SCHEMBL21179015 | 0.81 | RET (0.78) | RETCYP1A2HCKFGRRPS6KB1 | |
| SCHEMBL21801380 | 0.81 | RET (0.78) | RETCYP1A2HCKFGRRPS6KB1 | |
| SCHEMBL21801396 | 0.80 | RET (0.60) | RETCYP1A2HCKFGRRPS6KB1 | |
| SCHEMBL21801415 | 0.80 | RET (0.60) | RETCYP1A2HCKFGRRPS6KB1 | |
| SCHEMBL30893394 | 0.74 | RET (0.49) | RETPOLBALDH1A1 | |
| SCHEMBL29182308 | 0.74 | RET (0.49) | RETPOLBALDH1A1 | |
| SCHEMBL29456246 | 0.74 | RET (0.51) | RETCYP1A2HCKFGRRPS6KB1 | |
| SCHEMBL30893385 | 0.71 | RET (0.41) | RETPOLB | |
| SCHEMBL29182331 | 0.71 | RET (0.41) | RETPOLB |
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-112996794-A | Fused heterocyclic compounds as RET kinase inhibitors | 阿雷生物药品公司 | 2021-06-18 | — | — | CN | disclosed |