Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 1/20 | 0.45 |
| ▸ | PHGDH | O43175 | 8/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | ATP4A | P20648 | 1/20 | 0.34 |
| ▸ | ATP4B | P51164 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13860592 | 0.75 | ESRRA (0.53) | ESRRACYP11B1HSD11B1 | |
| SCHEMBL20382094 | 0.72 | ESRRA (0.65) | ESRRACYP11B1HSD11B1ASIC1ESR1 | |
| SCHEMBL12988852 | 0.72 | ESRRA (0.56) | ESRRACYP11B1HSD11B1ESR1ESR2 | |
| SCHEMBL4394707 | 0.72 | SMN1; SMN2 (0.36) | BRAFMAPK3MAPK1 | |
| SCHEMBL4692437 | 0.70 | FAAH (0.58) | ESRRAMAPK1ESR1ESR2 | |
| SCHEMBL12474102 | 0.68 | KDM4E (0.41) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL3103714 | 0.68 | MAPT (0.51) | PHGDHPTPN1MAPK1 | |
| SCHEMBL5333233 | 0.68 | HDAC3 (0.55) | PHGDHHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1372655 | 0.67 | HRH3 (0.54) | ESRRA | |
| SCHEMBL17279807 | 0.67 | ESRRA (0.58) | ESRRAPHGDHCYP11B1HSD11B1ASIC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017031276-A1 | METHODS OF PROVIDING NEUROPROTECTIVE THERAPY RELATED TO ADMINISTERING AN ESTROGEN RECEPTOR BETA LIGAND | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2017-02-23 | — | — | WO | disclosed |