Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | THPO | P40225 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3741295 | 0.73 | FFAR1 (0.42) | HIF1ALMNASLC6A3TDP1TSHR | |
| SCHEMBL29362308 | 0.73 | ALDH1A1 (0.52) | EGFRERBB2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL7473362 | 0.73 | EGFR (0.50) | EGFRERBB2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL2967462 | 0.73 | ALDH1A1 (0.52) | EGFRERBB2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL8829951 | 0.73 | EGFR (0.47) | EGFRERBB2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL30537036 | 0.72 | EGFR (0.49) | EGFRERBB2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL6447269 | 0.70 | ESR1 (0.54) | ALDH1A1CYP3A4SMN1; SMN2HIF1ALMNA | |
| SCHEMBL7132895 | 0.70 | GAA (0.36) | ALDH1A1CYP3A4SMN1; SMN2LMNAALOX15 | |
| SCHEMBL7506388 | 0.70 | EGFR (0.45) | EGFRERBB2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL8712988 | 0.69 | LMNA (0.46) | SMN1; SMN2LMNAKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011147254-A1 | PHENYLBUTYRYL CURCUMIN DERIVATIVES AND USES FOR PREPARING ANTI-TUMOR DRUGS THEREOF | 福建医科大学 (CN) | 2011-12-01 | — | — | WO | disclosed |