Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 3/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | REV1 | Q9UBZ9 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 2/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8045123 | 0.85 | KDM4E (0.33) | RXRARARARARBRARGRXRB | |
| SCHEMBL8062746 | 0.83 | RXRA (0.36) | RXRARARARARBRARGRXRB | |
| SCHEMBL8045035 | 0.81 | RXRA (0.40) | RXRARARARARBRARGRXRB | |
| SCHEMBL8062776 | 0.80 | ALDH1A1 (0.34) | RXRAALDH1A1LMNATSHRKDM4E | |
| SCHEMBL8045258 | 0.79 | BRAF (0.33) | ALDH1A1LMNATSHRKDM4EHSD17B10 | |
| SCHEMBL8062982 | 0.79 | ALDH1A1 (0.34) | RXRARARARARBRARGRXRB | |
| SCHEMBL8062745 | 0.78 | ALDH1A1 (0.34) | RXRAALDH1A1LMNAKDM4EHSD17B10 | |
| SCHEMBL8057402 | 0.78 | ALDH1A1 (0.36) | RXRAALDH1A1LMNATSHRKDM4E | |
| SCHEMBL8060815 | 0.76 | KDM4E (0.38) | ALDH1A1LMNATSHRKDM4EHSD17B10 | |
| SCHEMBL8057015 | 0.76 | RARB (0.44) | RARARARBRARGALDH1A1LMNA |
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-6028069-A | Heterocyclyl-condensed benzoylguanidines, their production and use as inhibitors of the cellular Na+/H+-antiporter | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKER HAFTUNG (DE) | 2000-02-22 | — | — | US | disclosed |