Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 4/20 | 0.39 |
| ▸ | TYR | P14679 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6993443 | 0.90 | HTR1A (0.46) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL28922778 | 0.89 | HTR1A (0.42) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL678728 | 0.80 | TAAR1 (0.54) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL18349 | 0.79 | HTR1A (0.46) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL14271047 | 0.79 | HTR1A (0.49) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL11582743 | 0.79 | HTR1A (0.49) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL4981775 | 0.77 | TAAR1 (0.41) | HTR1ATAAR1HRH3AKR1B1 | |
| SCHEMBL27644116 | 0.76 | LMNA (0.39) | HTR1ATAAR1MPOTYRAKR1B1 | |
| SCHEMBL28626643 | 0.75 | HTR1A (0.49) | HTR1ATAAR1TSHRHRH3HSPA5 | |
| SCHEMBL14271048 | 0.75 | HTR1A (0.49) | HTR1ATAAR1TSHRHRH3HSPA5 |
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-2147909-A1 | METHOD FOR PRODUCTION OF ISOCYANATE USING COMPOSITION COMPRISING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSPORT OR STORAGE OF CARBAMIC ACID ESTER | Asahi Kasei Chemicals Corporation (JP) | 2010-01-27 | — | — | EP | disclosed |