Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.61 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.54 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ABHD6 | Q9BV23 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL168265 | 0.87 | ESR2 (0.70) | ESR2NR1H2GPR119MAPK1MAPT | |
| SCHEMBL29407529 | 0.87 | ESR2 (0.70) | ESR2NR1H2GPR119MAPK1MAPT | |
| SCHEMBL29407557 | 0.83 | NR1H2 (0.69) | ESR2NR1H2GPR119MAPK1MAPT | |
| SCHEMBL1285596 | 0.83 | NR1H2 (0.69) | ESR2NR1H2GPR119MAPK1MAPT | |
| SCHEMBL3011371 | 0.82 | ESR2 (0.63) | ESR2NR1H2MAPK1MAPTABHD6 | |
| SCHEMBL3009208 | 0.82 | ESR2 (0.69) | ESR2NR1H2MAPK1MAPTABHD6 | |
| SCHEMBL30548176 | 0.82 | ESR2 (0.69) | ESR2NR1H2GPR119MAPK1MAPT | |
| SCHEMBL451998 | 0.82 | ESR2 (0.69) | ESR2NR1H2GPR119MAPK1MAPT | |
| SCHEMBL30409090 | 0.82 | ESR2 (0.69) | ESR2NR1H2MAPK1MAPTABHD6 | |
| SCHEMBL1365302 | 0.81 | ESR2 (0.67) | ESR2NR1H2MAPK1MAPTABHD6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018216823-A1 | ALPHA-AMINO AMIDE DERIVATIVES | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2018-11-29 | — | — | WO | disclosed |