Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GPR6 | P46095 | 1/20 | 0.36 |
| ▸ | MAP3K5 | Q99683 | 2/20 | 0.34 |
| ▸ | NNMT | P40261 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29002480 | 0.88 | NNMT (0.35) | KMT2AGPR6MAP3K5NNMTPARP1 | |
| SCHEMBL20524617 | 0.86 | KMT2A (0.42) | KMT2AGPR6MAP3K5GAAKDM4E | |
| SCHEMBL20524696 | 0.85 | NR4A2 (0.38) | KMT2AGPR6MAP3K5GAA | |
| SCHEMBL20524576 | 0.80 | GAA (0.39) | KMT2AMAP3K5NNMTGAAPOLB | |
| SCHEMBL22712271 | 0.73 | POLB (0.40) | KMT2AGPR6MAP3K5GAAKDM4E | |
| SCHEMBL22712254 | 0.72 | GAA (0.36) | KMT2AGPR6MAP3K5GAAKDM4E | |
| SCHEMBL21723855 | 0.71 | MAP3K5 (0.45) | KMT2AMAP3K5GAAPOLB | |
| SCHEMBL21724124 | 0.70 | MAP3K5 (0.44) | KMT2AMAP3K5KDM4EIRAK4 | |
| SCHEMBL21724299 | 0.68 | MAP3K5 (0.42) | KMT2AMAP3K5GAAKDM4EPOLB | |
| SCHEMBL20524627 | 0.68 | POLB (0.41) | KMT2AMAP3K5KDM4EPOLB |
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-110520127-B | Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 | 武田药品工业株式会社 | 2023-05-16 | — | — | CN | disclosed |