Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.53 |
| ▸ | MLNR | O43193 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 1/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL3364692 | 0.93 | MLNR (0.51) | LTA4HMLNRNR1I2ESR1NR3C1 | |
| SCHEMBL6011812 | 0.90 | LTA4H (0.60) | LTA4HS1PR1FAAHTP53TSHR | |
| Tetrabuthylammonium SCHEMBL1111588 | 0.86 | LTA4H (0.53) | LTA4HMLNRNR1I2ESR1NR3C1 | |
| SCHEMBL5704307 | 0.85 | KCNA3 (0.61) | LTA4HALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL28976715 | 0.83 | LTA4H (0.68) | LTA4HMLNRNR1I2ESR1NR3C1 | |
| SCHEMBL5584060 | 0.83 | S1PR1 (0.57) | LTA4HALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL6734325 | 0.83 | KCNA3 (0.59) | LTA4HALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL1172042 | 0.83 | KCNA3 (0.59) | LTA4HALDH1A1LMNAHTTSMN1; SMN2 | |
| Sulfuric Acid SCHEMBL1928145 | 0.83 | LTA4H (0.68) | LTA4HFAAHTP53TSHR | |
| Sulfuric Acid SCHEMBL2937396 | 0.82 | LTA4H (0.66) | LTA4HMLNRNR1I2ESR1NR3C1 |
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-2279192-B1 | IONIC LIQUIDS | MERCK PATENT GMBH (DE) | 2013-10-30 | — | — | EP | claimed |