Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | SRC | P12931 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.45 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24052971 | 0.86 | KMT2A (0.55) | KMT2ASRCMMP2MMP3PDE4A | |
| SCHEMBL5901064 | 0.84 | NPC1 (0.46) | KMT2AMMP1MMP9MMP13ALDH1A1 | |
| SCHEMBL28566434 | 0.82 | KMT2A (0.58) | KMT2ASRCMMP2MMP3PDE4A | |
| SCHEMBL28647560 | 0.82 | KMT2A (0.50) | KMT2ACA12CA9CA7CA14 | |
| SCHEMBL28254999 | 0.82 | SRC (0.62) | KMT2ASRCMEN1CYP2C19CYP2D6 | |
| SCHEMBL28034808 | 0.81 | KMT2A (0.56) | KMT2ASRCCA12CA9MEN1 | |
| SCHEMBL7388431 | 0.81 | KMT2A (0.56) | KMT2ASRCMMP2MMP3PDE4A | |
| SCHEMBL11829156 | 0.80 | GRIA4 (0.52) | ALDH1A1 | |
| SCHEMBL5133327 | 0.79 | SRC (0.48) | KMT2ASRCMEN1CYP2C19CYP2D6 | |
| SCHEMBL12965993 | 0.73 | KMT2A (0.44) | KMT2ACA12CA9CA7CA14 |
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-113666853-B | Biaryl compounds useful as ROR gamma modulators | 上海辉启生物医药科技有限公司 | 2023-04-18 | — | — | CN | disclosed |
| CN-113666853-A | Biaryl compounds useful as ROR gamma modulators | 上海辉启生物医药科技有限公司 | 2021-11-19 | — | — | CN | disclosed |