Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL16955754 | 0.88 | GABRA1 (0.46) | RXRARXRBGABRA1GABRB2HTR1D | |
| SCHEMBL16952545 | 0.83 | CES2 (0.39) | RXRARXRB | |
| SCHEMBL16955083 | 0.81 | TPMT (0.44) | RXRARXRBPOLBALDH1A1TSHR | |
| SCHEMBL16951056 | 0.79 | RXRA (0.44) | RXRARXRBGABRA1GABRB2HSPA5 | |
| SCHEMBL16962958 | 0.79 | ACHE (0.35) | GABRA1GABRB2HTR1DCYP2C19HTR1B | |
| SCHEMBL16953013 | 0.79 | GABRA1 (0.34) | GABRA1GABRB2HTR1DCYP2C19HTR1B | |
| SCHEMBL16956521 | 0.79 | NOTUM (0.37) | GABRA1GABRB2HTR1DSMN1; SMN2CYP2C19 | |
| SCHEMBL16956767 | 0.78 | HSPA5 (0.35) | GABRA1GABRB2HSPA5CYP2C19ACHE | |
| SCHEMBL16961626 | 0.77 | CYP1A2 (0.33) | RXRAGABRA1GABRB2 | |
| SCHEMBL16955876 | 0.77 | CA1 (0.39) | GABRA1GABRB2SMN1; SMN2ALDH1A1CA2 |
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 |