Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.36 |
| ▸ | GPR183 | P32249 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL29056767 | 0.87 | FLT3 (0.47) | HRH4AHRCYP2A6NR4A2NCEH1 | |
| SCHEMBL3381701 | 0.85 | HRH4 (0.43) | HRH4AHRNCEH1 | |
| SCHEMBL3836490 | 0.78 | FLT3 (0.50) | CYP2A6 | |
| SCHEMBL8889640 | 0.75 | HRH4 (0.55) | HRH4GPR183 | |
| SCHEMBL4036292 | 0.73 | DAO (0.50) | HRH4DYRK1A | |
| SCHEMBL3381954 | 0.72 | FLT3 (0.48) | HRH4AHRCYP2A6NR4A2NCEH1 | |
| SCHEMBL25305363 | 0.70 | NCEH1 (0.62) | CYP2A6NCEH1 | |
| SCHEMBL13504611 | 0.70 | PDPK1 (0.40) | METAP2DYRK1A | |
| SCHEMBL4033217 | 0.70 | DAO (0.50) | HRH4DYRK1A | |
| SCHEMBL19611005 | 0.70 | DRD4 (0.44) | — |
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-115943144-A | Compound serving as PAK4 kinase inhibitor and preparation method and application thereof | 成都海博为药业有限公司 | 2023-04-07 | — | — | CN | disclosed |
| CN-114075175-A | Compound serving as PAK4 kinase inhibitor and preparation method and application thereof | 成都海博为药业有限公司 | 2022-02-22 | — | — | CN | disclosed |