Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ARG2 | P78540 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PLG | P00747 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
| ▸ | CTRC | Q99895 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | TOP1 | P11387 | 1/20 | 0.33 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20211960 | 0.79 | MAOB (0.44) | MAOBCA1CA2ARG2CALM1 | |
| SCHEMBL7124438 | 0.75 | MAOB (0.46) | MAOBCMA1CCNB2CDK1CDK4 | |
| SCHEMBL7070788 | 0.75 | MAOB (0.46) | MAOBCMA1CCNB2CDK1CDK4 | |
| SCHEMBL29054488 | 0.74 | MAOB (0.48) | MAOBCA1CA2ARG2CALM1 | |
| SCHEMBL57808 | 0.73 | MAOB (0.52) | MAOBADH1BADH1CADH1AADH7 | |
| SCHEMBL19178921 | 0.72 | MAOB (0.46) | MAOBCA1CA2ARG2CALM1 | |
| Phenylacetaldehyde SCHEMBL3319438 | 0.71 | MAOB (0.63) | MAOBADH1BADH1CADH1AADH7 | |
| Phenylacetaldehyde SCHEMBL18972 | 0.71 | — | — | |
| Phenylacetaldehyde SCHEMBL31402006 | 0.71 | — | — | |
| Phenylacetaldehyde SCHEMBL31725265 | 0.71 | — | — |
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-105541581-A | Stereospecific synthesized tetra-substituted olefin compound and novel method therefor | UNIV ZHEJIANG | 2016-05-04 | — | — | CN | disclosed |