Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 3/20 | 0.43 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL976218 | 0.87 | ESR2 (0.58) | ESR2NR1H2MAPK1NAMPTADORA1 | |
| SCHEMBL1015935 | 0.87 | ESR2 (0.58) | ESR2NR1H2MAPK1NAMPTGPR119 | |
| SCHEMBL7795095 | 0.84 | ESR2 (0.49) | ESR2NR1H2MAPK1ADORA1KDM4E | |
| SCHEMBL3005376 | 0.79 | ESR2 (0.52) | ESR2NR1H2MAPK1GPR119ADORA1 | |
| SCHEMBL29676965 | 0.78 | MAPK1 (0.64) | ESR2NR1H2MAPK1HDAC1NAMPT | |
| SCHEMBL5183098 | 0.78 | MAPK1 (0.64) | ESR2NR1H2MAPK1HDAC1NAMPT | |
| SCHEMBL9182719 | 0.77 | ESR2 (0.49) | ESR2NR1H2MAPK1HDAC1NAMPT | |
| SCHEMBL30309375 | 0.76 | PDE4B (0.40) | ESR2NR1H2MAPK1NAMPTGPR119 | |
| SCHEMBL21807285 | 0.75 | MAPK1 (0.52) | ESR2NR1H2MAPK1HDAC1NAMPT | |
| SCHEMBL30816257 | 0.75 | HDAC1 (0.45) | ESR2NR1H2MAPK1HDAC1NAMPT |
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-105461733-A | (2,4-dihydroxy-5-isopropylphenyl)(4,6-dihydro-5H-thieno[2,3-c]pyrrol-5-yl)ketone derivative, preparation and uses thereof | SHANGHAI HANSEN BIOLOGICAL MEDICINE SCIENCE & TECH CO LTD | 2016-04-06 | — | — | CN | disclosed |