Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 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 | |
|---|---|---|---|---|
| SCHEMBL11563201 | 0.89 | PTGS1 (0.38) | PTGS1HTR7GPBAR1APEX1GABRA5 | |
| SCHEMBL11560465 | 0.85 | PTGS1 (0.36) | PTGS1GPBAR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11581271 | 0.85 | HTR7 (0.41) | PTGS1HTR7GPBAR1CYP1A1CYP1A2 | |
| SCHEMBL11560451 | 0.85 | HSD17B10 (0.43) | PTGS1HTR7GPBAR1SMN1; SMN2MAPT | |
| SCHEMBL11560540 | 0.83 | PTGS1 (0.33) | PTGS1APEX1GABRA5NPC1RAB9A | |
| SCHEMBL11558263 | 0.83 | GABRA5 (0.35) | PTGS1GPBAR1APEX1GABRPGABRD | |
| SCHEMBL11558638 | 0.83 | MAPK14 (0.37) | GABRA5MAPT | |
| SCHEMBL11557670 | 0.82 | CYP17A1 (0.41) | PTGS1GPBAR1CYP1A2NPC1RAB9A | |
| SCHEMBL11557764 | 0.82 | ESR1 (0.40) | CYP1A1CYP1A2CYP1B1NPC1RAB9A | |
| SCHEMBL11562701 | 0.82 | PTGS1 (0.42) | PTGS1HTR7GPBAR1APEX1CYP1A1 |
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-0002666-A1 | 1,2-Benzisoxazolyloxy (or thio) acetic acids and related compounds, process for their preparation and medicines containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-07-11 | — | — | EP | disclosed |