Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 7/20 | 0.33 |
| ▸ | KIF18A | Q8NI77 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL30080476 | 1.00 | CYP11B1 (0.38) | CYP11B1CYP11B2PDE10AKIF18AHCRTR1 | |
| SCHEMBL22304474 | 0.88 | KDM4E (0.33) | KIF18AALDH1A1KDM4EMAOBHTR6 | |
| SCHEMBL30080570 | 0.88 | KDM4E (0.33) | KIF18AALDH1A1KDM4EMAOBHTR6 | |
| SCHEMBL24915611 | 0.83 | PDE10A (0.45) | PDE10ACYP3A4 | |
| SCHEMBL29101044 | 0.82 | ADORA2A (0.43) | PDE10AKIF18AADORA2AALDH1A1KDM4E | |
| SCHEMBL22304481 | 0.81 | PDE10A (0.32) | PDE10AALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL20436569 | 0.80 | PDE10A (0.47) | PDE10AHCRTR1HCRTR2TRPV3 | |
| SCHEMBL22304528 | 0.79 | CYP11B1 (0.43) | CYP11B1CYP11B2PDE10AKIF18AHCRTR1 | |
| SCHEMBL26140270 | 0.78 | HTR3A (0.51) | PDE10AALDH1A1KDM4EHTR3EHTR3B | |
| SCHEMBL20436561 | 0.76 | OGA (0.42) | PDE10AALDH1A1KDM4ETRPV3MEN1 |
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-2020156505-A1 | 2-AMIONPYRIMIDINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINES | 江苏恒瑞医药股份有限公司 | 2020-08-06 | — | — | WO | disclosed |