Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5461009 | 0.77 | KEAP1 (0.43) | KEAP1NFE2L2CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL8038276 | 0.75 | KEAP1 (0.48) | KEAP1NFE2L2CYP3A4HSD17B10TSHR | |
| SCHEMBL3337887 | 0.75 | ALDH1A1 (0.41) | KEAP1NFE2L2TSHRCYP1A2ALDH1A1 | |
| SCHEMBL23496686 | 0.74 | KEAP1 (0.47) | KEAP1NFE2L2CYP3A4HSD17B10TSHR | |
| SCHEMBL10617307 | 0.74 | KEAP1 (0.47) | KEAP1NFE2L2CYP3A4HSD17B10TSHR | |
| SCHEMBL31267485 | 0.72 | KEAP1 (0.42) | KEAP1NFE2L2CYP3A4HSD17B10TSHR | |
| SCHEMBL27053764 | 0.71 | KEAP1 (0.44) | KEAP1NFE2L2CYP3A4HSD17B10TSHR | |
| SCHEMBL7006318 | 0.71 | KEAP1 (0.37) | KEAP1NFE2L2HSD17B10TSHRKDM4E | |
| SCHEMBL31267323 | 0.71 | KEAP1 (0.44) | KEAP1NFE2L2CYP3A4KDM4EMEN1 | |
| SCHEMBL4506073 | 0.70 | KEAP1 (0.39) | KEAP1NFE2L2HSD17B10TSHRL3MBTL1 |
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-2370438-A1 | IMIDAZO [1,2A]PYRIDINE DERIVATIVES, THEIR USE AS S1P1 AGONISTS AND METHODS FOR THEIR PRODUCTION | Exelixis, Inc. (US) | 2011-10-05 | — | — | EP | disclosed |