Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL28632360 | 0.91 | CCR3 (0.38) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL28632068 | 0.91 | NOS2 (0.39) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL22218175 | 0.90 | HDAC1 (0.38) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL28627811 | 0.89 | ATM (0.38) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL22236407 | 0.89 | BDKRB1 (0.41) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL22217768 | 0.89 | NPC1 (0.46) | MEN1KMT2ANPC1RAB9AMRGPRX4 | |
| SCHEMBL22217847 | 0.89 | ALDH1A1 (0.43) | MAPTNPC1RAB9AMRGPRX4HDAC1 | |
| SCHEMBL30177039 | 0.89 | ALDH1A1 (0.40) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL22217853 | 0.89 | ALDH1A1 (0.40) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL22217855 | 0.88 | ATM (0.36) | MEN1KMT2AMAPTNPC1RAB9A |
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-108137518-B | 1,3, 4-oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions comprising the same | 株式会社钟根堂 | 2021-08-31 | — | — | CN | disclosed |