Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6131064 | 0.80 | ABCG2 (0.53) | CLK4ADORA1ADORA2AKDM4EHPGD | |
| SCHEMBL27854208 | 0.76 | KMO (0.44) | ADORA1ADORA2AKDM4EKMOCYP3A4 | |
| SCHEMBL25649075 | 0.76 | NPC1 (0.46) | ADORA1ADORA2AKMOGRM5TP53 | |
| SCHEMBL4398415 | 0.75 | CLK4 (0.52) | CLK4KMOCYP3A4GRM5MAP4K4 | |
| SCHEMBL28198548 | 0.74 | CYP2A6 (0.56) | CLK4KDM4EHPGDRXFP1CYP1A2 | |
| SCHEMBL30629328 | 0.73 | ABCG2 (0.49) | RXFP1LMNAGABRG2GABRB3GABRA5 | |
| SCHEMBL28547944 | 0.72 | KMO (0.63) | ADORA2AKDM4EKMOGRM5MAP4K4 | |
| SCHEMBL14153105 | 0.72 | GABRG2 (0.48) | ADORA2BADORA1ADORA2AKDM4EHPGD | |
| SCHEMBL27095783 | 0.71 | TAAR1 (0.56) | KDM4ETP53 | |
| SCHEMBL5739331 | 0.71 | KMO (0.50) | ADORA2AKDM4EKMOGRM5MAP4K4 |
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-0390329-B1 | Pyrimidine derivative | SEIKO EPSON CORP (JP) | 1993-12-01 | — | — | EP | disclosed |