Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12864314 | 0.87 | ESR1 (0.43) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL2605969 | 0.79 | ALDH1A1 (0.43) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL12864215 | 0.76 | ESR1 (0.46) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL12864317 | 0.76 | ALDH1A1 (0.48) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL2606144 | 0.69 | ALDH1A1 (0.42) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL12864332 | 0.69 | ESR1 (0.36) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL12864217 | 0.67 | POLB (0.47) | ESR1ESR2MEN1KMT2ALMNA | |
| SCHEMBL2605984 | 0.67 | ALDH1A1 (0.48) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL2606095 | 0.64 | ESR1 (0.44) | ESR1ESR2ALDH1A1MEN1KMT2A | |
| SCHEMBL12864218 | 0.63 | ESR1 (0.48) | ESR1ESR2ALDH1A1MEN1KMT2A |
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-2009124627-A1 | FLUORINE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES | MERCK PATENT GMBH (DE) | 2009-10-15 | — | — | WO | disclosed |