Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.38 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL30472938 | 0.81 | CASP3 (0.46) | CASP3ALDH1A1POLBTTRCES1 | |
| SCHEMBL2156119 | 0.81 | CASP3 (0.46) | CASP3ALDH1A1POLBTTRCES1 | |
| SCHEMBL3275912 | 0.77 | CASP3 (0.43) | CASP3ALDH1A1POLBTTRCES1 | |
| SCHEMBL19067757 | 0.77 | CASP3 (0.43) | CASP3ALDH1A1POLBTTRCES1 | |
| SCHEMBL9944717 | 0.77 | CASP3 (0.43) | CASP3ALDH1A1POLBTTRCES1 | |
| SCHEMBL13243417 | 0.77 | NR1H3 (0.40) | CASP3ALDH1A1POLBNR1H3TTR | |
| SCHEMBL9190585 | 0.75 | POLB (0.46) | CASP3POLBCES1CYP1A2EHMT2 | |
| SCHEMBL23222939 | 0.75 | ALDH1A1 (0.42) | CASP3ALDH1A1CES1CHRM2 | |
| SCHEMBL8813029 | 0.74 | CASP3 (0.41) | CASP3ALDH1A1POLBTTRCES1 | |
| SCHEMBL4368833 | 0.74 | ALDH1A1 (0.44) | CASP3ALDH1A1POLBMEN1KMT2A |
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-106146623-A | The preparation of MTP-bi-axungia acyl-phosphatidylethanolamine derivative and application | 江苏东南纳米材料有限公司 | 2016-11-23 | — | — | CN | disclosed |