Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17135356 | 0.77 | CES1 (0.42) | CES1KCNN4SRCCYP1A2KMT2A | |
| SCHEMBL10710208 | 0.77 | ALDH1A1 (0.46) | CES1KCNN4CYP1A2KMT2AMAPT | |
| SCHEMBL19268144 | 0.76 | CES1 (0.61) | CES1KCNN4SRCKMT2AMAPT | |
| SCHEMBL17135268 | 0.75 | ALDH1A1 (0.45) | CES1KCNN4CYP1A2KMT2AMAPT | |
| SCHEMBL8036600 | 0.75 | KCNN4 (0.50) | CES1KCNN4SRCCYP1A2CYP2D6 | |
| SCHEMBL3700347 | 0.75 | KCNN4 (0.50) | CES1KCNN4SRCCYP1A2CYP2D6 | |
| SCHEMBL4365750 | 0.74 | CES1 (0.46) | CES1KCNN4SRCCYP1A2CYP2D6 | |
| SCHEMBL14881216 | 0.74 | CES1 (0.46) | CES1KCNN4SRCCYP1A2CYP2D6 | |
| SCHEMBL5130509 | 0.72 | KCNN4 (0.52) | CES1KCNN4SRCCYP1A2CYP2D6 | |
| Benzylic Acid SCHEMBL11870645 | 0.72 | CYP2C9 (0.63) | CES1KCNN4SRCCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2323613-B1 | COMPOSITE PARTICLES HAVING AN ANTIOXIDANT-BASED PROTECTIVE SYSTEM, AND TOPICAL COMPOSITIONS COMPRISING THE SAME | ELC MAN LLC (US) | 2016-11-30 | — | — | EP | claimed |