Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.42 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KPNA2 | P52292 | 1/20 | 0.37 |
| ▸ | EIF4E | P06730 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13425829 | 0.83 | ADORA2A (0.39) | KDM4EGLAGAASCN9ATSHR | |
| SCHEMBL3395686 | 0.80 | HSD17B1 (0.40) | KDM4ENPC1MAPTALDH1A1GLA | |
| SCHEMBL3395005 | 0.78 | DHFR (0.47) | KDM4EHSP90AA1HSP90AB1NPC1MAPT | |
| SCHEMBL3394338 | 0.76 | AR (0.41) | GLAGAASCN9ATSHRADORA2A | |
| SCHEMBL3128136 | 0.76 | ATR (0.48) | ADORA2AADORA1 | |
| SCHEMBL3399081 | 0.73 | ADORA2A (0.51) | KDM4ENPC1DYRK1AADORA2AADORA1 | |
| SCHEMBL19436331 | 0.73 | ADORA2A (0.60) | KDM4EACHEADORA2AADORA1 | |
| SCHEMBL4049824 | 0.72 | CRHR1 (0.40) | CRHR1NPC1MAPTLIMK1EIF4E | |
| SCHEMBL2324238 | 0.72 | ADORA2A (0.62) | KDM4ENPC1MAPTALDH1A1HTT | |
| SCHEMBL2322961 | 0.71 | ADORA2A (0.50) | KDM4ENPC1MAPTALDH1A1HPGD |
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 |