Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN5 | P54829 | 2/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.32 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16504154 | 0.79 | ELANE (0.32) | ELANEPOLBNPC1RAB9A | |
| SCHEMBL16160660 | 0.78 | ELANE (0.44) | PTPN5NR1H4ELANEPOLBKMT2A | |
| SCHEMBL18135085 | 0.76 | ELANE (0.50) | NR1H4ELANEPOLBKMT2ANPC1 | |
| SCHEMBL15762831 | 0.73 | NR1H4 (0.44) | PTPN5NR1H4ELANEPOLBKMT2A | |
| SCHEMBL13199355 | 0.73 | ELANE (0.33) | NR1H4ELANECYP3A4HTR2AESR1 | |
| SCHEMBL17420587 | 0.73 | PTPN5 (0.48) | PTPN5NR1H4POLBKMT2AALDH1A1 | |
| SCHEMBL13764947 | 0.73 | ELANE (0.47) | PTPN5NR1H4ELANEPOLBKMT2A | |
| SCHEMBL14701784 | 0.72 | ELANE (0.42) | NR1H4ELANECYP3A4HTR2AESR1 | |
| SCHEMBL15499124 | 0.72 | NPC1 (0.45) | PTPN5NR1H4ELANEPOLBKMT2A | |
| SCHEMBL13199223 | 0.71 | NPC1 (0.31) | ELANEPOLBNPC1RAB9A |
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 |