Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19934788 | 1.00 | CYP2C19 (0.33) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| SCHEMBL19934653 | 1.00 | CYP2C19 (0.33) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| SCHEMBL19934689 | 0.87 | MEN1 (0.34) | MEN1KMT2A | |
| SCHEMBL19934692 | 0.87 | MEN1 (0.34) | MEN1KMT2A | |
| SCHEMBL13934053 | 0.80 | — | — | |
| SCHEMBL21134690 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL21134882 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL21153031 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL21135256 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL21135006 | 0.77 | KDM4E (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018041245-A1 | AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION | 中国医学科学院放射医学研究所 | 2018-03-08 | — | — | WO | disclosed |