Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | RORA | P35398 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | RORB | Q92753 | 1/20 | 0.33 |
| ▸ | AVPR1B | P47901 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 2/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6109710 | 0.91 | MAPK8 (0.42) | GSK3BAVPR1BCNR2HSD17B10TSHR | |
| SCHEMBL6108293 | 0.90 | PGR (0.36) | GSK3BHIF1AAVPR1BCNR2HSD17B10 | |
| SCHEMBL6109022 | 0.89 | GSK3B (0.33) | GSK3BHIF1AAVPR1BCNR2HSD17B10 | |
| SCHEMBL6108734 | 0.89 | AVPR1B (0.38) | GSK3BAVPR1BCNR2SMN1; SMN2CNR1 | |
| SCHEMBL6109701 | 0.88 | ITGB1 (0.34) | GSK3BRORCAVPR1BCNR2HSD17B10 | |
| SCHEMBL6108549 | 0.88 | DPP4 (0.40) | AVPR1BHSD17B10SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL6106215 | 0.88 | DPP4 (0.41) | RORARORCRORBCNR2HSD17B10 | |
| SCHEMBL6107102 | 0.88 | RORA (0.35) | RORARORCRORBCNR2HSD17B10 | |
| SCHEMBL6110589 | 0.84 | RORA (0.33) | RORARORCRORBCNR2HSD17B10 | |
| SCHEMBL6110309 | 0.84 | CYP3A4 (0.37) | GSK3BAVPR1BMAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| US-7034039-B2 | Fused heterocyclic compounds | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2006-04-25 | — | — | US | disclosed |