Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.31 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | RAF1 | P04049 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28217215 | 1.00 | KCNQ2 (0.32) | KCNQ2HIF1AMEN1KMT2ATDP1 | |
| SCHEMBL28217232 | 0.97 | MEN1 (0.36) | HIF1AMEN1KMT2ATDP1HTR2C | |
| SCHEMBL28217235 | 0.97 | MEN1 (0.36) | HIF1AMEN1KMT2ATDP1HTR2C | |
| SCHEMBL28152053 | 0.89 | ALDH1A1 (0.43) | MEN1KMT2ATDP1ALDH1A1MAPT | |
| SCHEMBL28217676 | 0.85 | LMNA (0.38) | MEN1KMT2ATDP1ALDH1A1MAPT | |
| SCHEMBL28217678 | 0.85 | LMNA (0.38) | MEN1KMT2ATDP1ALDH1A1MAPT | |
| SCHEMBL8990154 | 0.83 | GABRA1 (0.43) | HIF1AMEN1KMT2ATDP1HTR2C | |
| SCHEMBL28217231 | 0.82 | CNR2 (0.36) | MEN1KMT2ATDP1ALDH1A1MAPT | |
| SCHEMBL28217234 | 0.82 | CNR2 (0.36) | MEN1KMT2ATDP1ALDH1A1MAPT | |
| SCHEMBL28217673 | 0.76 | DPP4 (0.32) | — |
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-108017559-B | Benzene ring derivative and application thereof in medicine | 四川海思科制药有限公司 | 2020-08-04 | — | — | CN | disclosed |
| CN-108017559-A | Phenyl ring derivative and its application in medicine | 四川海思科制药有限公司 | 2018-05-11 | — | — | CN | disclosed |