Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL26407559 | 0.89 | ADRB1 (0.43) | ADRB1ALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL24123868 | 0.87 | ADRB1 (0.48) | ADRB1ALDH1A1KMT2AMAPTKDM4E | |
| SCHEMBL19832328 | 0.86 | ADRB1 (0.52) | ADRB1ALDH1A1KMT2AMAPTKDM4E | |
| SCHEMBL22537876 | 0.85 | ADRB1 (0.50) | ADRB1ALDH1A1KMT2AMAPTKDM4E | |
| SCHEMBL12082265 | 0.84 | ADRB1 (0.42) | ADRB1ALDH1A1KMT2AUSP2CYP2D6 | |
| SCHEMBL12006357 | 0.83 | MAPT (0.69) | ALDH1A1KMT2AMAPTKDM4EGAA | |
| SCHEMBL14996510 | 0.83 | TP53 (0.54) | ALDH1A1KMT2AMAPTKDM4EGAA | |
| SCHEMBL18053442 | 0.81 | ADRB1 (0.43) | ADRB1ALDH1A1KMT2AMAPTNPC1 | |
| SCHEMBL26418599 | 0.81 | CYP2D6 (0.69) | ADRB1ALDH1A1KMT2AUSP2CYP2D6 | |
| SCHEMBL81814 | 0.81 | MAPT (0.65) | ADRB1ALDH1A1KMT2AMAPTKDM4E |
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-4169919-A1 | PYRAZOLO[3,4-D]PYRIMIDINE-3-KETONE DERIVATIVE AS WEE-1 INHIBITOR | Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) | 2023-04-26 | — | — | EP | disclosed |