Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 5/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CDC14B | O60729 | 2/20 | 0.39 |
| ▸ | CDC14A | Q9UNH5 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20205472 | 0.87 | CDC14B (0.43) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL21343381 | 0.86 | CDC14B (0.48) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL19132014 | 0.85 | NMUR2 (0.41) | ALOX5MAOACYP2C19MEN1KMT2A | |
| SCHEMBL18356959 | 0.85 | AHR (0.45) | ALOX5MAOACDC14BCDC14A | |
| SCHEMBL20205417 | 0.80 | ALOX5 (0.50) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL21971989 | 0.76 | CDC14B (0.46) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL21343396 | 0.76 | CDC14B (0.44) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL3081231 | 0.73 | ALDH1A1 (0.52) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL30550556 | 0.73 | ALDH1A1 (0.52) | ALOX5MAOACYP2C19KDM4EMEN1 | |
| SCHEMBL20927613 | 0.73 | TDP1 (0.39) | MAOACYP2C19KDM4EMEN1CYP3A4 |
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-3844243-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-06-22 | — | — | EP | disclosed |