Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | CASP1 | P29466 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | CDC14B | O60729 | 1/20 | 0.32 |
| ▸ | CDC14A | Q9UNH5 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12241283 | 0.84 | SIGMAR1 (0.38) | KDM4EALDH1A1HPGDSMN1; SMN2MAOA | |
| SCHEMBL26045473 | 0.83 | L3MBTL1 (0.41) | KDM4EALDH1A1HPGDMAPTCYP3A4 | |
| SCHEMBL27326345 | 0.82 | PLA2G2A (0.32) | — | |
| Formaldehyde SCHEMBL27552693 | 0.80 | KDM4E (0.38) | KDM4EALDH1A1HPGDSMN1; SMN2MAOA | |
| SCHEMBL30064082 | 0.79 | MAOA (0.50) | KDM4EALDH1A1HPGDSMN1; SMN2MAOA | |
| SCHEMBL12174099 | 0.78 | AHR (0.44) | KDM4EALDH1A1HPGDSMN1; SMN2MAOA | |
| SCHEMBL15889121 | 0.77 | MAPT (0.40) | KDM4EALDH1A1HPGDSMN1; SMN2MAOA | |
| SCHEMBL13629785 | 0.77 | MEN1 (0.37) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL21336983 | 0.76 | PLA2G2A (0.40) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL27345215 | 0.76 | BACE1 (0.33) | — |
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-2298774-A1 | HALOGEN COMPOUND, POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE POLYCYCLIC COMPOUND | Idemitsu Kosan Co., Ltd. (JP) | 2011-03-23 | — | — | EP | disclosed |