Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 6/20 | 0.49 |
| ▸ | ESR1 | P03372 | 9/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | ESRRG | P62508 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL16504152 | 0.88 | ELANE (0.45) | ELANE | |
| SCHEMBL19058050 | 0.78 | ELANE (0.76) | ELANEESR1ESR2TSHRCHRM2 | |
| SCHEMBL19648417 | 0.77 | ELANE (0.66) | ELANEHSD17B10ALDH1A1LMNAMAPK1 | |
| SCHEMBL13199224 | 0.77 | ELANE (0.39) | ELANEESR1ESR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL10392862 | 0.74 | ELANE (0.50) | ELANEESR1ESR2CYP3A4TSHR | |
| SCHEMBL15957708 | 0.73 | MAPT (0.41) | ELANEHSD17B10ALDH1A1LMNAMAPK1 | |
| SCHEMBL19020532 | 0.73 | ELANE (0.69) | ELANEESR1ESR2CYP3A4TSHR | |
| SCHEMBL16504170 | 0.72 | ESR1 (0.36) | ELANEESR1ESR2CHRM2BCHE | |
| SCHEMBL20275805 | 0.72 | ESR1 (0.53) | ELANEESR1ESR2CYP3A4TSHR | |
| SCHEMBL11497534 | 0.71 | ESR1 (0.61) | ELANEESR1ESR2CYP3A4TSHR |
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-2395040-A1 | FLUORINATED DICARBOXYLIC ACID DERIVATIVE AND POLYMER OBTAINED THEREFROM | Central Glass Company, Limited (JP) | 2011-12-14 | — | — | EP | disclosed |