Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.54 |
| ▸ | JAK2 | O60674 | 1/20 | 0.54 |
| ▸ | RNF4 | P78317 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31186740 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HTTNPC1RAB9APAX8 | |
| SCHEMBL31186721 | 0.81 | ALDH1A1 (0.60) | ALDH1A1HTTNPC1RAB9APAX8 | |
| SCHEMBL11033445 | 0.79 | MTNR1A (0.53) | ALDH1A1HTTNPC1RAB9APAX8 | |
| SCHEMBL16685476 | 0.79 | ALDH1A1 (0.55) | ALDH1A1HTTNPC1RAB9APAX8 | |
| SCHEMBL25710919 | 0.78 | PTGDR2 (0.55) | NPC1RAB9APTGDR2MTNR1BMTNR1A | |
| SCHEMBL9133855 | 0.77 | MTNR1A (0.51) | ALDH1A1HTTNPC1RAB9APAX8 | |
| SCHEMBL25525811 | 0.77 | PTGDR2 (0.54) | PTGDR2MTNR1BMTNR1APTGESALOX5 | |
| SCHEMBL23817970 | 0.77 | GPX4 (0.54) | ALDH1A1HTTNPC1RAB9APAX8 | |
| SCHEMBL25525382 | 0.75 | MTNR1A (0.58) | PTGDR2MTNR1BMTNR1APTGESALOX5 | |
| SCHEMBL28970975 | 0.74 | KDM4E (0.52) | ALDH1A1HTTNPC1RAB9APAX8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102731343-A | Nitrogen atom-polysubstituted micro-molecular organic aryl amide compounds and derivatives thereof, and application and preparation method thereof | UNIV EAST CHINA NORMAL | 2012-10-17 | — | — | CN | disclosed |