Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 7/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9000359 | 0.85 | SLC40A1 (0.37) | KDM4EALDH1A1GABRA1GABRB2HTR1A | |
| SCHEMBL11830127 | 0.85 | KDM4E (0.35) | KDM4EALDH1A1GABRA1GABRB2HTR1A | |
| SCHEMBL6115316 | 0.80 | TRIM24 (0.39) | KDM4EALDH1A1GABRA1GABRB2HTR1A | |
| SCHEMBL659486 | 0.80 | GABRA1 (0.37) | KDM4EALDH1A1GABRA1GABRB2HTR1A | |
| SCHEMBL472968 | 0.78 | LMNA (0.37) | KDM4EALDH1A1GABRA1GABRB2HTR1A | |
| SCHEMBL22239425 | 0.78 | NOS3 (0.42) | KDM4ECYP1A2MAPTLMNAL3MBTL1 | |
| Benzene SCHEMBL11824212 | 0.77 | TRIM24 (0.37) | KDM4EALDH1A1GABRA1GABRB2HTR1A | |
| SCHEMBL18215495 | 0.77 | NFE2L2 (0.51) | NFE2L2 | |
| SCHEMBL18024029 | 0.77 | RRM1 (0.41) | KDM4EALDH1A1CYP1A2MAPTLMNA | |
| SCHEMBL18802147 | 0.76 | GRIN1 (0.35) | KDM4EALDH1A1GABRA1GABRB2CYP1A2 |
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-2585462-B1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICALS CO (JP) | 2020-02-26 | — | — | EP | disclosed |