Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 3/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 7/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | VNN1 | O95497 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12864223 | 0.93 | CNR1 (0.41) | CHRM5CNR1CNR2PDK2ESR1 | |
| SCHEMBL12864224 | 0.86 | CES2 (0.45) | PDK2ESR1ESR2MEN1KMT2A | |
| SCHEMBL2605975 | 0.83 | PDK2 (0.46) | CHRM5PDK2ESR1ESR2MEN1 | |
| SCHEMBL13649845 | 0.82 | PDK2 (0.40) | PDK2ESR1ESR2MEN1KMT2A | |
| SCHEMBL10053610 | 0.82 | PDK2 (0.40) | PDK2ESR1ESR2MEN1KMT2A | |
| SCHEMBL12879929 | 0.81 | VNN1 (0.45) | PDK2VNN1 | |
| SCHEMBL2606066 | 0.80 | PDK2 (0.41) | CNR2PDK2THRBTDP1 | |
| SCHEMBL2605973 | 0.80 | VNN1 (0.41) | CNR1CNR2PDK2ESR1ESR2 | |
| SCHEMBL1167840 | 0.79 | TDP1 (0.52) | CNR1CNR2PDK2ESR1ESR2 | |
| SCHEMBL2606070 | 0.79 | SRD5A2 (0.41) | CNR1CNR2PDK2ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2260023-B1 | FLUORENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES | MERCK PATENT GMBH (DE) | 2012-04-25 | — | — | EP | disclosed |