Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 7/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21439307 | 0.90 | MAPK8 (0.44) | CD38CYP3A4MEN1NR1I2LMNA | |
| SCHEMBL2972655 | 0.88 | LMNA (0.50) | CYP3A4MEN1NR1I2LMNACHRM2 | |
| SCHEMBL27556126 | 0.83 | CYP3A4 (0.46) | CD38CYP3A4MEN1NR1I2LMNA | |
| SCHEMBL30499962 | 0.83 | MAPK8 (0.47) | CD38CYP3A4MEN1NR1I2LMNA | |
| SCHEMBL19695740 | 0.83 | MAPK8 (0.47) | CD38CYP3A4MEN1NR1I2LMNA | |
| SCHEMBL5370893 | 0.83 | CYP3A4 (0.53) | CYP3A4MEN1NR1I2LMNACHRM2 | |
| SCHEMBL6258469 | 0.82 | ALDH1A1 (0.46) | CYP3A4MEN1NR1I2LMNACHRM2 | |
| SCHEMBL6285466 | 0.82 | CYP3A4 (0.45) | CYP3A4MEN1NR1I2LMNACHRM2 | |
| SCHEMBL28293673 | 0.82 | MEN1 (0.41) | CYP3A4MEN1NR1I2LMNACHRM2 | |
| SCHEMBL6535320 | 0.81 | LMNA (0.55) | CYP3A4MEN1NR1I2LMNACHRM2 |
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-104341351-B | A kind of Diarylthiohydantoin derivative and its application | 北京海美源医药科技有限公司 | 2018-02-06 | — | — | CN | disclosed |