Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.79 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.79 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.67 |
| ▸ | RORC | P51449 | 1/20 | 0.57 |
| ▸ | RET | P07949 | 1/20 | 0.54 |
| ▸ | WNT3A | P56704 | 1/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.53 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4803134 | 0.94 | MEN1 (0.69) | MEN1KMT2AEPHX2RORCWNT3A | |
| SCHEMBL1283623 | 0.94 | KMT2A (0.79) | MEN1KMT2AEPHX2RORCRET | |
| SCHEMBL28043487 | 0.90 | EPHX2 (0.76) | MEN1KMT2AEPHX2BCHEACHE | |
| SCHEMBL3714852 | 0.89 | KMT2A (1.00) | MEN1KMT2AEPHX2RORCRET | |
| SCHEMBL694917 | 0.87 | EPHX2 (0.76) | MEN1KMT2AEPHX2BCHEACHE | |
| SCHEMBL10054999 | 0.85 | EPHX2 (0.92) | MEN1KMT2AEPHX2BCHEACHE | |
| SCHEMBL1516167 | 0.81 | EPHX2 (1.00) | MEN1KMT2AEPHX2BCHEACHE | |
| SCHEMBL1948079 | 0.80 | KMT2A (0.83) | MEN1KMT2AEPHX2RORCWNT3A | |
| SCHEMBL4802418 | 0.80 | MEN1 (0.66) | MEN1KMT2AEPHX2RORCWNT3A | |
| Hydrochloric Acid SCHEMBL27735879 | 0.79 | EPHX2 (0.96) | MEN1KMT2AEPHX2BCHEACHE |
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-102750459-A | Anti-HPV (human papillomavirus) medicine virtual screening method by using DNA helicase E1 of HPV as target point | UNIV LIAONING | 2012-10-24 | — | — | CN | disclosed |