Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 1/20 | 0.69 |
| ▸ | PI4KA | P42356 | 1/20 | 0.69 |
| ▸ | XDH | P47989 | 1/20 | 0.69 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.69 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.69 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.69 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.69 |
| ▸ | FLT3 | P36888 | 8/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PAK1 | Q13153 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL30405325 | 1.00 | RET (0.69) | RETPI4KAXDHLRRK2PI4K2B | |
| SCHEMBL29351045 | 0.83 | XDH (1.00) | RETPI4KAXDHLRRK2PI4K2B | |
| SCHEMBL11363 | 0.83 | XDH (1.00) | RETPI4KAXDHLRRK2PI4K2B | |
| Hydrochloric Acid SCHEMBL1741653 | 0.81 | XDH (0.96) | RETPI4KAXDHLRRK2PI4K2B | |
| SCHEMBL26658661 | 0.81 | XDH (0.96) | RETPI4KAXDHLRRK2PI4K2B | |
| Hydrochloric Acid SCHEMBL30403903 | 0.81 | XDH (0.96) | RETPI4KAXDHLRRK2PI4K2B | |
| Hydrochloric Acid SCHEMBL14742346 | 0.81 | XDH (0.96) | RETPI4KAXDHLRRK2PI4K2B | |
| Trifluoroacetic Acid SCHEMBL5235125 | 0.77 | PI4KA (0.38) | RETPI4KAXDHLRRK2PI4K2B | |
| Trifluoroacetic Acid SCHEMBL29971319 | 0.75 | NOTUM (0.48) | RETLRRK2KDRABL1 | |
| Trifluoroacetic Acid SCHEMBL28330499 | 0.75 | NOTUM (0.48) | RETLRRK2KDRABL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118027041-A | BTK inhibitor ring derivative and preparation method and pharmaceutical application thereof | 西藏海思科制药有限公司 | 2024-05-14 | — | — | CN | disclosed |
| CN-113544130-B | BTK inhibitor ring derivative and preparation method and pharmaceutical application thereof | 西藏海思科制药有限公司 | 2024-01-09 | — | — | CN | disclosed |