Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | KDM1A | O60341 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28210785 | 0.99 | KMT2A (0.47) | KMT2AFKBP1AGLAKDM1AMAOA | |
| SCHEMBL30916938 | 0.85 | KMT2A (0.48) | KMT2AFKBP1AGLAALDH1A1ESR1 | |
| SCHEMBL28858446 | 0.82 | ALDH1A1 (0.50) | KMT2AFKBP1AGLAALDH1A1USP2 | |
| SCHEMBL4710815 | 0.81 | HTR6 (0.51) | KMT2AFKBP1AGLAKDM1AMAOA | |
| SCHEMBL25168200 | 0.79 | FKBP1A (0.49) | KMT2AFKBP1AGLAALDH1A1USP2 | |
| SCHEMBL28211325 | 0.77 | KCNT1 (0.43) | KMT2AFKBP1AGLAALDH1A1CYP2D6 | |
| SCHEMBL28211341 | 0.76 | KCNT1 (0.53) | KMT2AFKBP1AGLAALDH1A1CYP2D6 | |
| SCHEMBL18923917 | 0.74 | KDM1A (0.64) | FKBP1AKDM1AMAOAMAOBALDH1A1 | |
| SCHEMBL30754642 | 0.74 | TDO2 (0.60) | KMT2AHTR6MEN1PKM | |
| SCHEMBL29978821 | 0.73 | MAP2K4 (0.52) | ALDH1A1USP2CYP2D6HTR6ALOX15 |
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-115151542-A | 1,3, 4-oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions comprising the same | 株式会社钟根堂 | 2022-10-04 | — | — | CN | disclosed |