Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.34 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | GPR6 | P46095 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.32 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20934776 | 0.85 | SLC6A2 (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL24222172 | 0.82 | PRSS1 (0.45) | MAOAMAOBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2492152 | 0.82 | TSHR (0.47) | TSHRNPFFR2KMT2AMAPT | |
| Hydrogen Sulfide SCHEMBL28190447 | 0.81 | TSHR (0.45) | TSHRNPFFR2KMT2AMAPT | |
| SCHEMBL14962353 | 0.79 | MAOA (0.40) | MAOAMAOBKMT2A | |
| SCHEMBL981100 | 0.78 | NPFFR2 (0.50) | NPFFR2RAPGEF4 | |
| SCHEMBL2797872 | 0.78 | TAS1R3 (0.46) | TSHRTAS1R3TAS1R1TAS1R2CYP1A2 | |
| SCHEMBL6236442 | 0.78 | TDP1 (0.42) | TSHRCYP3A4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL979455 | 0.78 | CYP3A4 (0.34) | MAOACYP3A4RAPGEF4 | |
| SCHEMBL16689397 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101652354-A | insecticidal aryl isoxazoline derivatives | BAYER CROPSCIENCE AG DE | 2010-02-17 | — | — | CN | disclosed |