Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 18/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10660008 | 0.86 | GPBAR1 (0.37) | GPBAR1PTGS1 | |
| SCHEMBL10643048 | 0.81 | GPBAR1 (0.39) | GPBAR1PTGS1 | |
| SCHEMBL10737555 | 0.80 | STK17B (0.38) | SLC22A12GPBAR1PTGS1 | |
| SCHEMBL10663114 | 0.78 | PPARA (0.44) | SLC22A12GPBAR1PTGS1 | |
| SCHEMBL10644625 | 0.78 | POLB (0.41) | GPBAR1PTGS1 | |
| SCHEMBL10659368 | 0.77 | PPARA (0.40) | GPBAR1PTGS1 | |
| SCHEMBL10663477 | 0.74 | PPARA (0.40) | GPBAR1PTGS1 | |
| SCHEMBL10658344 | 0.73 | PTGS1 (0.42) | GPBAR1PTGS1 | |
| SCHEMBL11558673 | 0.73 | PTGS1 (0.45) | GPBAR1PTGS1 | |
| SCHEMBL10642629 | 0.73 | GPBAR1 (0.38) | GPBAR1PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | claimed |
| US-4728662-A | DIURETICS, URICOSURICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1988-03-01 | — | — | US | disclosed |
| US-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | disclosed |