Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GRM5 | P41594 | 9/20 | 0.44 |
| ▸ | PTGIR | P43119 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22312249 | 0.80 | KMT2A (0.52) | ALDH1A1GRM5MEN1KMT2AKDM4E | |
| SCHEMBL20218965 | 0.79 | RAB9A (0.41) | ALDH1A1GRM5PTGIRMEN1KMT2A | |
| SCHEMBL1019064 | 0.77 | PPIB (0.52) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL18464173 | 0.76 | MAPT (0.39) | ALDH1A1PTGIRMEN1KMT2AKDM4E | |
| SCHEMBL26660394 | 0.76 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2AKDM4ENPC1 | |
| SCHEMBL22981283 | 0.74 | PTGIR (0.39) | GRM5PTGIR | |
| SCHEMBL18464237 | 0.74 | HDAC6 (0.39) | ALDH1A1GRM5PTGIRKDM4ENPC1 | |
| SCHEMBL29200923 | 0.74 | PTGIR (0.39) | GRM5PTGIR | |
| SCHEMBL29659061 | 0.74 | PTGIR (0.39) | GRM5PTGIR | |
| Hydrochloric Acid SCHEMBL26660410 | 0.73 | ALDH1A1 (0.52) | ALDH1A1KMT2ANPC1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3330259-B1 | 1,3,4-OXADIAZOLE AMIDE DERIVATIVE COMPOUND AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2020-06-10 | — | — | EP | disclosed |