Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | MLYCD | O95822 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MAT2A | P31153 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27389289 | 0.76 | BRD4 (0.61) | TDO2BRD4BRD2PTGS2PTGS1 | |
| SCHEMBL9674379 | 0.75 | PTGS1 (0.46) | TDO2POLBESR1ESR2BRD4 | |
| SCHEMBL8764932 | 0.75 | MLYCD (0.63) | TDO2POLBESR1ESR2BRD4 | |
| SCHEMBL11014937 | 0.68 | MLYCD (0.42) | TDO2BRD4BRD2MLYCDPTGS2 | |
| SCHEMBL6151679 | 0.66 | EDNRA (0.72) | TSHR | |
| SCHEMBL9063613 | 0.66 | EDNRA (0.72) | TSHR | |
| SCHEMBL7849998 | 0.64 | EDNRA (0.69) | TSHR | |
| SCHEMBL17532585 | 0.63 | TDO2 (1.00) | TDO2TSHRKDM4ETDP1 | |
| SCHEMBL5613767 | 0.62 | EPHX2 (0.50) | ESR1ESR2LMNA | |
| SCHEMBL10503592 | 0.62 | MLYCD (0.64) | TDO2BRD4MLYCDENPP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0375670-B1 | Process for preparing 3-polyfluoroalkylisoxazolylamines | SHIONOGI & CO (JP) | 1997-08-06 | — | — | EP | disclosed |
| EP-0375670-A2 | Process for preparing 3-polyfluoroalkylisoxazolylamines | SHIONOGI & CO., LTD. (JP) | 1990-06-27 | — | — | EP | disclosed |