Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 4/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ATR | Q13535 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | CHUK | O15111 | 2/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3364050 | 0.86 | ADORA1 (0.47) | ADORA1ADORA2AKDM4EALDH1A1POLB | |
| SCHEMBL3425059 | 0.80 | ADORA2A (0.56) | ADORA1ADORA2AKDM4EALDH1A1POLB | |
| SCHEMBL3366260 | 0.76 | MAP3K14 (0.50) | ADORA1ADORA2AKDM4EALDH1A1POLB | |
| SCHEMBL3364120 | 0.75 | EGLN2 (0.47) | ADORA1ADORA2AMAP3K14 | |
| SCHEMBL3366418 | 0.74 | ADORA2A (0.56) | ADORA1ADORA2AKDM4EALDH1A1LMNA | |
| SCHEMBL3362920 | 0.73 | PTPN1 (0.52) | ADORA1ADORA2AKDM4EALDH1A1POLB | |
| SCHEMBL3397294 | 0.72 | HRH3 (0.51) | ADORA1ADORA2A | |
| SCHEMBL3021383 | 0.72 | ADORA1 (0.59) | ADORA1ADORA2ALMNAGRM4 | |
| SCHEMBL3364838 | 0.71 | MAP3K14 (0.46) | ADORA1ADORA2AKDM4ELMNAMAP3K14 | |
| SCHEMBL3365876 | 0.71 | MAP3K14 (0.43) | ADORA1ADORA2AMAP3K14CHUK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |