Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 2/20 | 0.45 |
| ▸ | BRD4 | O60885 | 13/20 | 0.39 |
| ▸ | BRD2 | P25440 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | USP7 | Q93009 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL1670795 | 0.83 | AR (0.44) | MLYCDBRD4BRD2ESR1ESR2 | |
| SCHEMBL12800382 | 0.81 | MLYCD (0.42) | MLYCDBRD4BRD2BRD3ERN1 | |
| SCHEMBL12801001 | 0.78 | BRD4 (0.39) | MLYCDBRD4BRD2BRD3ERN1 | |
| SCHEMBL12801014 | 0.77 | ERN1 (0.41) | MLYCDBRD4BRD2BRD3ERN1 | |
| SCHEMBL12800390 | 0.75 | BRD4 (0.43) | MLYCDBRD4BRD2BRD3ERN1 | |
| SCHEMBL12362813 | 0.74 | BRD4 (0.66) | MLYCDBRD4BRD2ERN1CREBBP | |
| SCHEMBL12808114 | 0.74 | BRD4 (0.45) | MLYCDBRD4BRD2BRD3ERN1 | |
| Hydrochloric Acid SCHEMBL23174957 | 0.73 | BRD4 (0.63) | MLYCDBRD4BRD2ERN1CREBBP | |
| SCHEMBL12800997 | 0.72 | BRD4 (0.42) | MLYCDBRD4BRD2ERN1JAK2 | |
| SCHEMBL10200524 | 0.68 | MAP4K4 (0.56) | MLYCDBRD4BRD2JAK2USP7 |
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-2011042477-A1 | SUBSTITUTED PYRROLES AND IMIDAZOLES AS ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2011-04-14 | — | — | WO | disclosed |