Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 1/20 | 0.50 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | GALR3 | O60755 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28905087 | 0.85 | DGAT1 (0.52) | ALDH2ALDH1A3ESR1ESR2MGLL | |
| SCHEMBL17907309 | 0.83 | DGAT1 (0.42) | ALDH2ALDH1A3MEN1KMT2ADGAT1 | |
| SCHEMBL16532097 | 0.83 | DGAT1 (0.42) | ALDH2ALDH1A3MEN1KMT2ADGAT1 | |
| SCHEMBL18509639 | 0.83 | DGAT1 (0.38) | ALDH2ALDH1A3KMT2ADGAT1CTDSP1 | |
| SCHEMBL18509638 | 0.80 | DGAT1 (0.36) | ALDH2ALDH1A3MEN1KMT2ADGAT1 | |
| SCHEMBL16960361 | 0.79 | DGAT1 (0.44) | KMT2ADGAT1TP53CES2GALR3 | |
| SCHEMBL21317684 | 0.79 | ALDH2 (0.39) | ALDH2ALDH1A3KMT2ADGAT1CTDSP1 | |
| SCHEMBL14230833 | 0.78 | ESR1 (0.58) | ALDH2ALDH1A3ESR1ESR2MGLL | |
| SCHEMBL14230831 | 0.78 | ESR1 (0.58) | ALDH2ALDH1A3ESR1ESR2MGLL | |
| SCHEMBL31107436 | 0.78 | ESR1 (0.58) | ALDH2ALDH1A3ESR1ESR2MGLL |
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-2013078440-A2 | ENHANCED TREATMENT REGIMENS USING MTOR INHIBITORS | INTELLIKINE, LLC (US) | 2013-05-30 | — | — | WO | disclosed |