Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 10/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17563610 | 0.74 | MEN1 (0.54) | ADORA1MEN1KMT2AADORA3ADORA2A | |
| SCHEMBL6501260 | 0.71 | MEN1 (0.66) | ADORA1MEN1KMT2AADORA3ADORA2A | |
| SCHEMBL5475337 | 0.70 | CYP2D6 (0.54) | KMT2AKDM4ETSHR | |
| SCHEMBL14749339 | 0.70 | CYP2D6 (0.54) | KMT2AKDM4ETSHR | |
| SCHEMBL1483328 | 0.70 | CYP2D6 (0.54) | KMT2AKDM4ETSHR | |
| SCHEMBL4651196 | 0.70 | PDPK1 (0.39) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL7833643 | 0.69 | FFAR2 (0.39) | ALDH1A1KDM4ETSHR | |
| SCHEMBL1733453 | 0.68 | KDM4E (0.57) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL30938002 | 0.67 | ADORA1 (0.61) | ADORA1MEN1KMT2AADORA3ADORA2A | |
| SCHEMBL22623614 | 0.67 | MEN1 (0.44) | ADORA1MEN1KMT2AADORA3ADORA2A |
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-2005033085-A1 | PYRIMIDINES DERIVATIVES AS ADENOSINE RECEPTORS LIGANDS | UNIVERSITEIT LEIDEN (NL) | 2005-04-14 | — | — | WO | disclosed |