Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.58 |
| ▸ | FADS1 | O60427 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.41 |
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | NOS2 | P35228 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30000930 | 0.82 | KEAP1 (0.61) | KEAP1FADS1HDAC1CES2CES1 | |
| SCHEMBL29080415 | 0.82 | MAPT (0.53) | ALDH1A1NOS2KDM4EGAAMAPT | |
| SCHEMBL9042482 | 0.82 | KEAP1 (0.61) | KEAP1FADS1HDAC1CES2CES1 | |
| SCHEMBL5507340 | 0.81 | MAPT (0.49) | ALDH1A1NOS2KDM4EGAAMAPT | |
| SCHEMBL9665493 | 0.80 | KEAP1 (0.68) | KEAP1FADS1HDAC1CES2CES1 | |
| SCHEMBL29467969 | 0.80 | KEAP1 (0.68) | KEAP1FADS1HDAC1CES2CES1 | |
| SCHEMBL11575664 | 0.79 | KDM4E (0.58) | HDAC1CES2ALDH1A1NOS2KDM4E | |
| SCHEMBL10964252 | 0.79 | NOS2 (0.60) | FADS1ALDH1A1NOS2KDM4EGAA | |
| SCHEMBL9376769 | 0.79 | KEAP1 (0.61) | KEAP1FADS1HDAC1CES2CES1 | |
| SCHEMBL5795078 | 0.79 | KEAP1 (0.61) | KEAP1FADS1HDAC1CES2CES1 |
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-4169091-A | Symmetrical and asymmetrical disazo compounds containing a bis-(nitro-aryloxy)alkane middle component | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-09-25 | — | — | US | disclosed |