Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16960031 | 0.82 | OPRL1 (0.33) | ADRA2AADRA2BADRA2COPRL1GRIA1 | |
| SCHEMBL16950960 | 0.80 | HTR2C (0.43) | ADRA2AADRA2BADRA2CHTR2CPDK2 | |
| SCHEMBL16950597 | 0.80 | ADRA2A (0.36) | ADRA2AADRA2BADRA2CHTR2CPDK2 | |
| SCHEMBL16952157 | 0.79 | NOTUM (0.36) | ADRA2AADRA2BADRA2CHTR2CSLC6A2 | |
| SCHEMBL16953158 | 0.79 | ADRA2A (0.35) | ADRA2AADRA2BADRA2CHTR2CPDK2 | |
| SCHEMBL16954946 | 0.78 | OPRL1 (0.34) | OPRL1 | |
| SCHEMBL16952945 | 0.76 | ADRA2A (0.34) | ADRA2AADRA2BADRA2CHTR2CGABRA1 | |
| SCHEMBL16962728 | 0.76 | ADRA2A (0.37) | ADRA2AADRA2BADRA2CHTR2CSLC6A2 | |
| SCHEMBL16955619 | 0.76 | ADRA2A (0.34) | ADRA2AADRA2BADRA2CHTR2CPDK2 | |
| SCHEMBL3794742 | 0.76 | OPRL1 (0.41) | OPRL1HTR2CSLC6A2TSHRHTR2B |
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-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |