Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.36 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31460333 | 0.86 | HDAC1 (0.41) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL20738563 | 0.86 | HDAC1 (0.41) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL9918101 | 0.84 | HDAC1 (0.40) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL28036918 | 0.84 | HDAC1 (0.40) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL20392575 | 0.82 | HDAC1 (0.43) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL12451984 | 0.82 | HDAC1 (0.39) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL6893628 | 0.82 | NR1H2 (0.40) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL14358443 | 0.82 | HDAC1 (0.40) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL23372983 | 0.81 | HDAC1 (0.46) | NR1H2HDAC1ESR2MAPK1NAMPT | |
| SCHEMBL24506914 | 0.81 | SLC34A1 (0.46) | NR1H2HDAC1ESR2MAPK1NAMPT |
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-105037367-A | Amino six-membered ring derivative and application thereof in medicines | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2015-11-11 | — | — | CN | disclosed |