Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 4/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | GPR3 | P46089 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.42 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17616023 | 0.85 | GPR3 (0.52) | KDM4EALDH1A1GAAGLAHPGD | |
| Hydrochloric Acid SCHEMBL9499951 | 0.80 | GPR3 (0.47) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL28836465 | 0.77 | KDM4E (0.53) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL22070145 | 0.77 | KDM4E (0.46) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL28836488 | 0.76 | KDM4E (0.49) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL17953141 | 0.74 | GAA (0.51) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL8927397 | 0.72 | ALDH1A1 (0.72) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL9309343 | 0.72 | GPR3 (0.56) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL10467315 | 0.72 | ALDH1A1 (0.43) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL483003 | 0.71 | GPR3 (0.61) | KDM4EALDH1A1GAAGLAHPGD |
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-1993353-B | Substituted indolyl alkylamino derivatives as novel inhibitors of histone deacetylase | JANSSEN PHARMACEUTICA NV | 2010-12-01 | — | — | CN | disclosed |
| CN-1993353-A | Substituted indolyl alkylamino derivatives as novel inhibitors of histone deacetylase | JANSSEN PHARMACEUTICA NV (BE) | 2007-07-04 | — | — | CN | disclosed |