Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL80897 | 0.83 | TSHR (0.41) | TSHRKMT2AALDH1A1ADRA2BADRA2C | |
| SCHEMBL5831072 | 0.81 | CA1 (0.33) | TSHRKMT2AALDH1A1LMNAHPGD | |
| Acetonitrile SCHEMBL27856444 | 0.76 | MAOB (0.37) | TSHRKMT2AALDH1A1IDO1 | |
| SCHEMBL24027472 | 0.74 | TSHR (0.36) | TSHRKMT2ATRPA1ALDH1A1LMNA | |
| SCHEMBL2261012 | 0.73 | TSHR (0.39) | TSHRKMT2AALDH1A1SLC6A2SLC6A3 | |
| SCHEMBL2252915 | 0.73 | TSHR (0.41) | TSHRKMT2AALDH1A1ADRA2BADRA2C | |
| SCHEMBL12380718 | 0.72 | FFAR1 (0.35) | TSHRKMT2AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL2227585 | 0.72 | TSHR (0.40) | TSHRKMT2AALDH1A1ADRA2BADRA2C | |
| SCHEMBL4881254 | 0.71 | MAOB (0.34) | TSHRKMT2AALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL6578072 | 0.71 | LTA4H (0.44) | TSHRALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-7037486-B1 | Labelled phosphoinositides and analogues | NUTRIMED BIOTECH (US) | 2006-05-02 | — | — | US | disclosed |