Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8579199 | 0.99 | CNR2 (0.38) | ALDH1A1MEN1KMT2ACNR2PPARA | |
| SCHEMBL8581514 | 0.95 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2ACNR2MAOA | |
| SCHEMBL8580404 | 0.93 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ACNR2PPARA | |
| SCHEMBL8581767 | 0.91 | CNR2 (0.38) | ALDH1A1MEN1KMT2ACNR2PPARA | |
| SCHEMBL8580954 | 0.89 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ACNR2PPARA | |
| SCHEMBL8578774 | 0.88 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2APPARAPPARG | |
| SCHEMBL8580856 | 0.87 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2ACNR2MAOA | |
| SCHEMBL8581034 | 0.86 | PPARA (0.40) | ALDH1A1MEN1KMT2ACNR2PPARA | |
| SCHEMBL8585560 | 0.85 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ACNR2PPARA | |
| SCHEMBL8581250 | 0.85 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ACNR2PPARA |
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-5840761-A | Alkylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-11-24 | — | — | US | disclosed |