Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.59 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.59 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | ABL1 | P00519 | 2/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.53 |
| ▸ | BCR | P11274 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8500193 | 0.98 | ESR1 (0.61) | ESR1ESR2MAOBABL1ABCB1 | |
| SCHEMBL17912881 | 0.88 | MAOB (0.61) | ESR1ESR2MAOBABL1ABCB1 | |
| SCHEMBL9622898 | 0.88 | MAOB (0.61) | ESR1ESR2MAOBABL1ABCB1 | |
| SCHEMBL9939154 | 0.84 | ESR1 (0.57) | ESR1ESR2MAOBABL1ABCB1 | |
| SCHEMBL9383500 | 0.81 | ESR1 (0.46) | ESR1ESR2MAOBABL1ABCB1 | |
| SCHEMBL24101484 | 0.80 | ESR1 (0.49) | ESR1ESR2MAOBABL1ABCB1 | |
| SCHEMBL8204839 | 0.80 | ALDH1A1 (0.70) | ESR1ESR2MAOBABL1ABCB1 | |
| Methane SCHEMBL27404638 | 0.79 | MAOB (0.67) | ESR1ESR2MAOBMEN1KMT2A | |
| SCHEMBL216905 | 0.78 | KMT2A (0.62) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL31553173 | 0.78 | KMT2A (0.62) | ESR1ESR2ABL1ABCB1BCR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105111054-A | Curcumin analogue with enlarged conjugated system and preparation method and application thereof | UNIV LIAOCHENG | 2015-12-02 | — | — | CN | claimed |
| CN-105111054-B | A kind of curcumin analogue of conjugated system increase and its preparation method and application | 聊城大学 | 2017-03-15 | — | — | CN | disclosed |
| CN-105111054-A | Curcumin analogue with enlarged conjugated system and preparation method and application thereof | UNIV LIAOCHENG | 2015-12-02 | — | — | CN | disclosed |