Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | CLCN2 | P51788 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | F2R | P25116 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16955104 | 0.86 | TAAR1 (0.33) | GABRA1GABRB2HTTLMNAMRGPRX4 | |
| SCHEMBL16957823 | 0.84 | GABRA1 (0.42) | GABRA1GABRB2HTR1ADRD2DRD4 | |
| SCHEMBL16959503 | 0.81 | KAT6A (0.46) | GABRA1GABRB2CLCN2HTTKAT6A | |
| SCHEMBL16958341 | 0.81 | GABRA1 (0.43) | GABRA1GABRB2CLCN2HTTKAT6A | |
| SCHEMBL16952451 | 0.81 | GABRA1 (0.46) | GABRA1GABRB2HTR1ADRD2DRD4 | |
| SCHEMBL16952951 | 0.80 | GABRA1 (0.42) | GABRA1GABRB2CLCN2HTTKAT6A | |
| SCHEMBL16952007 | 0.79 | CYP11B1 (0.38) | ALDH1A1 | |
| SCHEMBL16951918 | 0.79 | TSHR (0.48) | TAS1R3TAS1R1TAS1R2ALDH1A1F2R | |
| SCHEMBL16951114 | 0.79 | GABRA1 (0.55) | GABRA1GABRB2CLCN2HTTKAT6A | |
| SCHEMBL16951096 | 0.78 | TSHR (0.43) | HTTALDH1A1LMNAKDM4E |
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 |