Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | FKBP1A | P62942 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4001428 | 0.86 | POLB (0.56) | KEAP1FKBP1AKMT2AGLASMN1; SMN2 | |
| SCHEMBL7839074 | 0.83 | FKBP1A (0.66) | FKBP1AMAPTKMT2AHTTGLA | |
| SCHEMBL2512424 | 0.81 | FKBP1A (0.69) | FKBP1AMAPTKMT2AHTTGLA | |
| SCHEMBL28211411 | 0.81 | TRPV4 (0.50) | KEAP1FKBP1AKMT2AGLAALDH1A1 | |
| SCHEMBL1853129 | 0.79 | POLB (0.71) | FKBP1AKMT2AGLAALOX15MEN1 | |
| SCHEMBL4710815 | 0.79 | HTR6 (0.51) | KEAP1FKBP1AKMT2AGLAPOLB | |
| SCHEMBL30916886 | 0.79 | FKBP1A (0.47) | KEAP1FKBP1AMAPTKMT2AHTT | |
| SCHEMBL18424892 | 0.77 | FKBP1A (0.46) | KEAP1FKBP1AMAPTKMT2AHTT | |
| SCHEMBL28211326 | 0.77 | PKM (0.52) | FKBP1AMAPTKMT2AGLAALDH1A1 | |
| SCHEMBL28210751 | 0.76 | FKBP1A (0.42) | FKBP1AMAPTKMT2AHTTGLA |
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-107980040-A | 1,3,4- oxadiazoles sulfamide derivative as 6 inhibitor of histone deacetylase enzyme and the medical composition containing it | 株式会社钟根堂 | 2018-05-01 | — | — | CN | disclosed |