Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BMP1 | P13497 | 3/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | GSTK1 | Q9Y2Q3 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 5/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 6/20 | 0.33 |
| ▸ | MMP3 | P08254 | 4/20 | 0.32 |
| ▸ | FCER2 | P06734 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19934736 | 1.00 | BMP1 (0.41) | BMP1ACEPTGS1GSTK1KDM4E | |
| SCHEMBL21153272 | 0.86 | PTGS1 (0.44) | BMP1ACEPTGS1GSTK1KDM4E | |
| SCHEMBL4988312 | 0.86 | BMP1 (0.44) | BMP1ACEPTGS1GSTK1KDM4E | |
| SCHEMBL9483609 | 0.82 | KDM4E (0.59) | ACEPTGS1GSTK1KDM4EMAPT | |
| SCHEMBL12157389 | 0.82 | BMP1 (0.45) | BMP1ACEPTGS1GSTK1KDM4E | |
| SCHEMBL13322789 | 0.82 | KDM4E (0.44) | ACEPTGS1GSTK1KDM4EMAPT | |
| SCHEMBL9483614 | 0.82 | KDM4E (0.59) | ACEPTGS1GSTK1KDM4EMAPT | |
| SCHEMBL24287312 | 0.82 | PTGS1 (0.44) | BMP1ACEPTGS1GSTK1KDM4E | |
| SCHEMBL22792931 | 0.82 | PTGS1 (0.44) | BMP1ACEPTGS1GSTK1KDM4E | |
| SCHEMBL13978592 | 0.82 | BMP1 (0.37) | BMP1ACEPTGS1GSTK1KDM4E |
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 |