Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 11/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9956465 | 0.85 | GPBAR1 (0.46) | GPBAR1HTR7BRD4GABRA5PTGS1 | |
| SCHEMBL286321 | 0.81 | PTGS2 (0.55) | GPBAR1BRD4GABRA5PTGS1PTGS2 | |
| SCHEMBL195456 | 0.81 | PTGS2 (0.58) | BRD4PTGS1PTGS2ALDH1A1GAA | |
| SCHEMBL16720790 | 0.80 | GPBAR1 (0.50) | GPBAR1HTR7GABRA5PTGS1PTGS2 | |
| SCHEMBL4974000 | 0.79 | GABRA5 (0.51) | GPBAR1HTR7GABRA5ALDH1A1 | |
| SCHEMBL27918170 | 0.77 | GPBAR1 (0.63) | GPBAR1GABRA5ALDH1A1GAATSHR | |
| SCHEMBL2471876 | 0.75 | GPBAR1 (0.62) | GPBAR1BRD4GABRA5ALDH1A1GAA | |
| SCHEMBL4594713 | 0.75 | GPBAR1 (0.62) | GPBAR1GABRA5ALDH1A1GAATSHR | |
| SCHEMBL9954345 | 0.74 | BRD4 (0.44) | GPBAR1HTR7BRD4PTGS1PTGS2 | |
| SCHEMBL25624237 | 0.74 | PTGS2 (0.39) | GPBAR1GABRA5PTGS1PTGS2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103313982-A | Phenyl-isoxazole derivatives and process for the preparation thereof | IL YANG PHARM CO LTD | 2013-09-18 | — | — | CN | claimed |
| WO-2020040343-A1 | ISOXAZOLE DERIVATIVES AND PREPARATION PROCESS THEREOF | IL-YANG PHARM. CO., LTD. (KR) | 2020-02-27 | — | — | WO | disclosed |
| CN-103313982-A | Phenyl-isoxazole derivatives and process for the preparation thereof | IL YANG PHARM CO LTD | 2013-09-18 | — | — | CN | disclosed |