Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 3/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 4/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | FKBP4 | Q02790 | 1/20 | 0.33 |
| ▸ | NPY1R | P25929 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | GNRHR | P30968 | 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 | |
|---|---|---|---|---|
| SCHEMBL21781988 | 0.91 | KDM1A (0.41) | AKT1FKBP4KDM1A | |
| SCHEMBL21782019 | 0.85 | SMN1; SMN2 (0.40) | MAPK14SMN1; SMN2MAPK1CYP3A4 | |
| SCHEMBL21782055 | 0.83 | FKBP4 (0.39) | AKT1MMP3MMP1FKBP4KDM1A | |
| SCHEMBL21781926 | 0.80 | AKT1 (0.42) | AKT1 | |
| SCHEMBL21782113 | 0.79 | AKT1 (0.41) | AKT1CYP3A4KDM1A | |
| SCHEMBL21781982 | 0.78 | AKT1 (0.31) | AKT1 | |
| SCHEMBL22561364 | 0.78 | KDM1A (0.39) | AKT1MMP1USP30FKBP4KDM1A | |
| SCHEMBL21781948 | 0.77 | AKT1 (0.41) | AKT1CYP3A4 | |
| SCHEMBL22561427 | 0.77 | KLKB1 (0.44) | MMP1FKBP4 | |
| SCHEMBL21781778 | 0.76 | KLKB1 (0.40) | AKT1MMP1FKBP4KDM1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3617221-A1 | CYTOTOXIN AND CONJUGATE, USES OF SAME, AND PREPARATION METHOD THEREFOR | Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) | 2020-03-04 | — | — | EP | disclosed |