Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16951804 | 0.87 | TUBB4A (0.44) | ADRA2AADRA1ACYP2D6HTTESR1 | |
| SCHEMBL16952192 | 0.86 | CYP2D6 (0.54) | ADRA2AADRA1ACYP2D6HTTCA12 | |
| SCHEMBL16954392 | 0.83 | CYP2D6 (0.47) | ADRA2AADRA1ACYP2D6HTTCALM1 | |
| SCHEMBL16953667 | 0.81 | CYP2D6 (0.45) | ADRA2AADRA1ACYP2D6HTTCA12 | |
| SCHEMBL16950474 | 0.80 | MAPT (0.45) | MAPTTSHRKDM4ELMNANPSR1 | |
| SCHEMBL16961105 | 0.79 | MTNR1A (0.48) | ADRA2AADRA1ACYP2D6CALM1MTNR1A | |
| SCHEMBL16952990 | 0.79 | L3MBTL1 (0.39) | CYP2D6MAPTNPSR1GAAKMT2A | |
| SCHEMBL16954198 | 0.79 | HPGD (0.49) | HTTMAPTTSHRLMNANPSR1 | |
| SCHEMBL16951022 | 0.79 | GAA (0.51) | CYP2D6MAPTTSHRLMNAHPGD | |
| SCHEMBL16953257 | 0.79 | HTT (0.39) | ADRA2AADRA1ACYP2D6HTTESR1 |
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 |