Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 5/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6992932 | 0.99 | EPHX2 (0.43) | EPHX2CYP17A1FAAHMGLLHTR1B | |
| SCHEMBL5617847 | 0.78 | CYP17A1 (0.41) | CYP17A1FAAHMGLLHTR1BTAAR1 | |
| SCHEMBL5618398 | 0.78 | CYP17A1 (0.49) | CYP17A1FAAHMGLLHTR1BSSTR4 | |
| Hydrochloric Acid SCHEMBL6992470 | 0.78 | CYP17A1 (0.41) | CYP17A1FAAHMGLLHTR1BSMN1; SMN2 | |
| SCHEMBL6990623 | 0.78 | FAAH (0.36) | EPHX2FAAHMGLLMAOBTAAR1 | |
| Hydrochloric Acid SCHEMBL6996249 | 0.77 | CYP17A1 (0.48) | CYP17A1FAAHMGLLHTR1BSSTR4 | |
| Hydrochloric Acid SCHEMBL6994704 | 0.77 | CYP17A1 (0.40) | CYP17A1FAAHMGLLHTR1BTAAR1 | |
| Hydrochloric Acid SCHEMBL6994883 | 0.75 | CYP17A1 (0.44) | CYP17A1FAAHMGLLHTR1BSMN1; SMN2 | |
| SCHEMBL6992223 | 0.75 | SCN9A (0.43) | EPHX2SSTR4 | |
| Hydrochloric Acid SCHEMBL6990457 | 0.74 | CYP17A1 (0.38) | CYP17A1FAAHMGLLHTR1BTAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1162957-A | Isoxazole derivatives | SANKYO CO (JP) | 1997-10-22 | — | — | CN | disclosed |