Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | AAK1 | Q2M2I8 | 7/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | PRKCI | P41743 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | PLEC | Q15149 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.39 |
| ▸ | LNPEP | Q9UIQ6 | 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 | |
|---|---|---|---|---|
| SCHEMBL17336829 | 0.88 | ALOX15 (0.58) | ALOX15AAK1CYP17A1PRKCIMAPT | |
| SCHEMBL29446496 | 0.88 | ALOX15 (0.58) | ALOX15AAK1CYP17A1PRKCIMAPT | |
| SCHEMBL14876842 | 0.88 | GAA (0.54) | ALOX15AAK1CYP17A1PRKCIMAPT | |
| SCHEMBL4516629 | 0.87 | MAPT (0.55) | ALOX15AAK1CYP17A1MAPTGAA | |
| SCHEMBL21648056 | 0.86 | ALOX15 (0.44) | ALOX15AAK1CYP17A1PRKCIMAPT | |
| SCHEMBL25254382 | 0.86 | CSF1R (0.46) | AAK1CYP17A1HDAC1 | |
| SCHEMBL5869074 | 0.83 | ABCC9 (0.48) | ALOX15AAK1CYP17A1MAPTGAA | |
| SCHEMBL3410364 | 0.83 | HPGD (0.49) | ALOX15AAK1CYP17A1ALDH1A1HPGD | |
| SCHEMBL15160030 | 0.83 | GAA (0.52) | ALOX15AAK1CYP17A1MAPTGAA | |
| SCHEMBL753526 | 0.82 | PTGER4 (0.57) | ALOX15AAK1GAAERAP2LNPEP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113461602-B | Aniline compounds with HDAC (Histone deacetylase) inhibitory activity, preparation method, composition and application | 北京华氏信华科生物科技有限公司 | 2022-06-28 | — | — | CN | disclosed |
| CN-113461602-A | Aniline compounds with HDAC (HDAC) inhibitory activity, preparation method, composition and application | 北京华氏信华科生物科技有限公司 | 2021-10-01 | — | — | CN | disclosed |