Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BID | P55957 | 3/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.48 |
| ▸ | PPARA | Q07869 | 3/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.48 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.48 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | SAE1 | Q9UBE0 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28850518 | 0.98 | BID (0.50) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL28186455 | 0.98 | BID (0.50) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL6285466 | 0.95 | CYP3A4 (0.45) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL6919325 | 0.94 | CYP3A4 (0.48) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL6919329 | 0.94 | BID (0.48) | BIDMCL1PPARABCL2L1BAK1 | |
| Charcoal, Activated SCHEMBL9345982 | 0.94 | CYP3A4 (0.44) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL5370893 | 0.90 | CYP3A4 (0.53) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL14688680 | 0.89 | MEN1 (0.45) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL6535320 | 0.88 | LMNA (0.55) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL28371050 | 0.88 | LMNA (0.55) | BIDMCL1PPARABCL2L1BAK1 |
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-2020244754-A1 | METHOD AND SENSOR FOR DETECTION OF TRIACETONE TRIPEROXIDE (TATP), DIACETONE DIPEROXIDE (DADP), HEXAMETHYLENE TRIPEROXIDE DIAMINE (HMTD) AND HYDROGEN PEROXIDE | BUNDESREPUBLIK DEUTSCHLAND, VERTRETEN DURCH DEN BUNDESMINISTER FÜR WIRTSCHAFT UND ENERGIE, DIESER VERTRETEN DURCH DEN PRÄSIDENTEN DER BUNDESANSTALT FÜR MATERIALFORSCHUNG UND - PRÜFUNG (BAM) (DE) | 2020-12-10 | — | — | WO | disclosed |