Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 6/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | TOP2A | P11388 | 2/20 | 0.33 |
| ▸ | TOP2B | Q02880 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20907699 | 1.00 | MEN1 (0.36) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL29640325 | 1.00 | MEN1 (0.36) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL23114934 | 0.93 | AAK1 (0.38) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL20907700 | 0.93 | AAK1 (0.38) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL29640266 | 0.93 | AAK1 (0.38) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL21112599 | 0.90 | MEN1 (0.39) | MEN1KMT2ACTSSAAK1CTSB | |
| SCHEMBL21112602 | 0.90 | MEN1 (0.39) | MEN1KMT2ACTSSAAK1CTSB | |
| SCHEMBL20907560 | 0.90 | MEN1 (0.37) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL29640241 | 0.90 | MEN1 (0.37) | MEN1KMT2ACTSSAAK1ATM | |
| SCHEMBL28407708 | 0.90 | MEN1 (0.37) | MEN1KMT2ACTSSAAK1ATM |
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-111212832-A | 1-benzyl-2-imino-4-phenyl-5-oxoimidazolidine derivatives as HIV protease inhibitors | 吉利德科学公司 | 2020-05-29 | — | — | CN | disclosed |