Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | REN | P00797 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.34 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.34 |
| ▸ | NMUR1 | Q9HB89 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.34 |
| ▸ | ACE | P12821 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21782125 | 0.95 | CYP3A4 (0.39) | AKT1CYP3A4RENOPRM1OPRD1 | |
| SCHEMBL21782113 | 0.93 | AKT1 (0.41) | AKT1CYP3A4LCKOPRM1OPRD1 | |
| SCHEMBL21781883 | 0.89 | AKT1 (0.40) | AKT1CYP3A4LCKOPRM1OPRD1 | |
| SCHEMBL21781797 | 0.87 | AKT1 (0.39) | AKT1CYP3A4LCKOPRM1OPRD1 | |
| SCHEMBL21781948 | 0.87 | AKT1 (0.41) | AKT1CYP3A4LCKOPRM1OPRD1 | |
| SCHEMBL21781926 | 0.87 | AKT1 (0.42) | AKT1LCKITGB1ITGA5NMUR2 | |
| SCHEMBL21781950 | 0.85 | CYP3A4 (0.46) | AKT1CYP3A4RENOPRD1 | |
| SCHEMBL21782101 | 0.85 | AKT1 (0.39) | AKT1OPRM1OPRD1ITGB1ITGA5 | |
| SCHEMBL21781988 | 0.84 | KDM1A (0.41) | AKT1LCKMEN1KMT2A | |
| SCHEMBL21781845 | 0.83 | ITGB1 (0.41) | AKT1LCKOPRM1OPRD1ITGB1 |
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 |