Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | EBP | Q15125 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL451576 | 0.89 | ALDH1A1 (0.43) | HTR2ATSHRPAM | |
| Styrene SCHEMBL9488136 | 0.85 | ALDH1A1 (0.50) | HTR2ATSHRPAM | |
| SCHEMBL10558462 | 0.85 | NR1I2 (0.46) | NR1I2DRD2ADRA2CCNR1SLC6A2 | |
| SCHEMBL10457001 | 0.83 | CHAT (0.44) | TSHRCHATHDAC8HDAC6 | |
| SCHEMBL15421494 | 0.81 | HTR2A (0.38) | HTR2ASIGMAR1MEN1TSHRKMT2A | |
| SCHEMBL8175856 | 0.80 | RXRA (0.49) | CYP1A2CYP2D6CHATHDAC8HDAC6 | |
| SCHEMBL7006267 | 0.80 | RXRA (0.49) | CYP1A2CYP2D6CHATHDAC8HDAC6 | |
| Styrene SCHEMBL138405 | 0.80 | ALDH1A1 (0.56) | MEN1TSHRKMT2ACHATHDAC8 | |
| SCHEMBL10951988 | 0.80 | CHAT (0.44) | TSHRCHATHDAC8HDAC6 | |
| SCHEMBL6169645 | 0.80 | CHAT (0.47) | NR1I2DRD2ADRA2CCNR1SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20190077894-A1 | PROCESS FOR PREPARING CATALYSTS | LANXESS DEUTSCHLAND GMBH (DE) | 2019-03-14 | — | — | US | claimed |
| US-20150353660-A1 | PROCESS FOR PREPARING CATALYSTS | LANXESS DEUTSCHLAND GMBH (DE) | 2015-12-10 | — | — | US | claimed |
| US-9006457-B2 | Reactive ionic liquids | BASF SE (DE) | 2015-04-14 | — | — | US | disclosed |