Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | THRB | P10828 | 2/20 | 0.56 |
| ▸ | ESR1 | P03372 | 2/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15559042 | 0.85 | ALOX15 (0.57) | ALDH1A1KMT2AMAPTESR1HIF1A | |
| SCHEMBL4655036 | 0.84 | ESR1 (0.43) | ALDH1A1KMT2AMAPTMEN1THRB | |
| SCHEMBL27728358 | 0.83 | CA12 (0.57) | ALDH1A1KMT2AMAPTESR1HIF1A | |
| SCHEMBL27728359 | 0.83 | CA12 (0.57) | ALDH1A1KMT2AMAPTESR1HIF1A | |
| SCHEMBL11576231 | 0.82 | CA12 (0.55) | ALDH1A1KMT2AMAPTESR1HIF1A | |
| SCHEMBL28950410 | 0.81 | ALDH1A1 (0.61) | ALDH1A1KMT2AMAPTMEN1THRB | |
| SCHEMBL27511728 | 0.81 | ALDH1A1 (0.61) | ALDH1A1KMT2AMAPTMEN1THRB | |
| SCHEMBL13720135 | 0.81 | GAA (0.50) | ALDH1A1KMT2AMAPTMEN1ESR1 | |
| SCHEMBL21509621 | 0.79 | ACHE (0.60) | ALDH1A1KMT2AESR1HIF1ARECQL | |
| SCHEMBL13201523 | 0.79 | MAPT (0.48) | ALDH1A1KMT2AMAPTMEN1ESR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105849119-B | Beta-hairpin peptidomimetics | 波利弗尔股份公司 | 2021-01-19 | — | — | CN | disclosed |
| CN-105849119-A | Beta-hairpin peptidomimetics | 波利弗尔股份公司 | 2016-08-10 | — | — | CN | disclosed |