Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30851436 | 1.00 | KEAP1 (0.57) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| SCHEMBL1239113 | 1.00 | KEAP1 (0.57) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27412576 | 0.98 | KEAP1 (0.55) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| SCHEMBL3042980 | 0.98 | ALDH1A1 (0.56) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| SCHEMBL23161511 | 0.93 | SMN1; SMN2 (0.56) | NPSR1GAAMAPK1ALDH1A1TSHR | |
| SCHEMBL29709408 | 0.85 | ALDH1A1 (0.54) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| SCHEMBL27934132 | 0.83 | MAPK1 (0.74) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| SCHEMBL5716359 | 0.83 | NPSR1 (0.49) | KEAP1NPSR1GAAMAPK1ALDH1A1 | |
| SCHEMBL4717743 | 0.81 | NCF1 (0.59) | ALDH1A1TSHRSMN1; SMN2KDM4EPOLB | |
| SCHEMBL19187683 | 0.81 | ADRB1 (0.55) | ALDH1A1TSHRKDM4EHSD17B10CYP1A2 |
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-1637521-A1 | NOVEL TRICYCLIC HETEROCYCLE COMPOUND | ONO PHARMACEUTICAL CO., LTD. (JP) | 2006-03-22 | — | — | EP | disclosed |