Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.34 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.32 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 4/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.31 |
| ▸ | RORC | P51449 | 2/20 | 0.31 |
| ▸ | CNR1 | P21554 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6109987 | 0.88 | GSK3B (0.36) | HSD17B10TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL6109923 | 0.87 | THRA (0.32) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL6109839 | 0.87 | AAK1 (0.32) | HSD17B10KDM4EALDH1A1CNR2SMN1; SMN2 | |
| SCHEMBL6109710 | 0.87 | MAPK8 (0.42) | HSD17B10TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL6108293 | 0.86 | PGR (0.36) | ITGB1ITGA4ITGB7HSD17B10TSHR | |
| SCHEMBL6109022 | 0.85 | GSK3B (0.33) | HSD17B10TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL6108262 | 0.85 | ALDH1A1 (0.38) | HSD17B10KDM4EALDH1A1HPGDCNR2 | |
| SCHEMBL6108545 | 0.85 | HTR3E (0.32) | HPGDSMN1; SMN2 | |
| SCHEMBL6106931 | 0.85 | RXFP1 (0.33) | ALDH1A1AVPR1BCNR2CNR1 | |
| SCHEMBL6111468 | 0.85 | MAPK8 (0.38) | HSD17B10TSHRKDM4EALDH1A1GSK3B |
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 |