Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 8/20 | 0.69 |
| ▸ | CYSLTR1 | Q9Y271 | 8/20 | 0.69 |
| ▸ | LMNA | P02545 | 4/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.68 |
| ▸ | NPC1 | O15118 | 3/20 | 0.68 |
| ▸ | RAB9A | P51151 | 3/20 | 0.68 |
| ▸ | PKM | P14618 | 1/20 | 0.68 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.65 |
| ▸ | PFKFB3 | Q16875 | 2/20 | 0.65 |
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.55 |
| ▸ | BCHE | P06276 | 1/20 | 0.55 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL2399852 | 0.86 | KDM4E (0.71) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL2399856 | 0.86 | KDM4E (0.71) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL10275355 | 0.86 | PFKFB3 (0.81) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL10309039 | 0.86 | PFKFB3 (0.81) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL10275157 | 0.85 | PFKFB3 (0.74) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL5507715 | 0.85 | PFKFB3 (0.74) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| Acetic Acid SCHEMBL10401610 | 0.83 | KDM4E (0.81) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| Acetic Acid SCHEMBL10401609 | 0.83 | KDM4E (0.81) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL6175619 | 0.82 | CYSLTR2 (1.00) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 | |
| SCHEMBL6175612 | 0.82 | CYSLTR2 (1.00) | CYSLTR2CYSLTR1LMNAKDM4ENPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1596240-A | Chalcone derivatives and their use for the treatment of diseases | ATHEROGENICS INC (US) | 2005-03-16 | — | — | CN | disclosed |