Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JUN | P05412 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27926953 | 0.81 | ERN1 (0.43) | ABCG2LMNAPTGS2PTGS1ERN1 | |
| SCHEMBL27926949 | 0.80 | TDP1 (0.50) | CYP1A2TDP1PDE4BALDH1A1SMN1; SMN2 | |
| SCHEMBL4876301 | 0.73 | KMT2A (0.47) | CYP1A2ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL14198023 | 0.71 | CYP1A1 (0.58) | JUNNFKB1ABCG2NFE2L2CYP1A1 | |
| SCHEMBL7138832 | 0.71 | JUN (0.58) | JUNNFKB1ABCG2NFE2L2CYP1A1 | |
| SCHEMBL6933869 | 0.70 | GAA (0.50) | NFE2L2CYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL22596690 | 0.68 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2LMNAMEN1KMT2A | |
| SCHEMBL29392394 | 0.68 | ALDH1A1 (0.71) | JUNNFKB1ABCG2NFE2L2CYP1A1 | |
| SCHEMBL172939 | 0.68 | ALDH1A1 (0.71) | JUNNFKB1ABCG2NFE2L2CYP1A1 | |
| SCHEMBL3559786 | 0.67 | HTR3E (0.58) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E |
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-103181922-A | Application of piperidone-containing single-carbonyl curcumin compound in preparation of anti-inflammatory drug | WENZHOU MEDICAL COLLEGE | 2013-07-03 | — | — | CN | disclosed |