Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRB | O95718 | 7/20 | 0.62 |
| ▸ | ESR1 | P03372 | 11/20 | 0.46 |
| ▸ | ESRRG | P62508 | 7/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PLD2 | O14939 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | ESRRA | P11474 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5075269 | 0.87 | ESR1 (0.60) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL5075821 | 0.85 | THRA (0.53) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL5075263 | 0.83 | THRA (0.56) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL4637955 | 0.82 | ESR1 (0.60) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL4637821 | 0.81 | ESR1 (0.50) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL5004320 | 0.79 | ESR1 (0.52) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL10016270 | 0.77 | ESRRB (1.00) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL20534069 | 0.77 | ESRRB (1.00) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL21294103 | 0.75 | MAOB (0.65) | KDM4EMEN1ALDH1A1KMT2ATHRA | |
| SCHEMBL3813207 | 0.73 | CYP19A1 (0.57) | ESR1ESR2KDM4EMEN1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1951250-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007062151-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-05-31 | — | — | WO | disclosed |