Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10655745 | 0.82 | NPC1 (0.43) | GPBAR1PTGS1MAPTHPGDTSHR | |
| SCHEMBL10738125 | 0.80 | PPARG (0.44) | GPBAR1PTGS1MAPTHPGDTSHR | |
| SCHEMBL10663114 | 0.80 | PPARA (0.44) | GPBAR1PTGS1MAPTMEN1KMT2A | |
| SCHEMBL4035353 | 0.80 | FFAR4 (0.44) | GPBAR1PTGS1HPGDALDH1A1FFAR4 | |
| SCHEMBL10657284 | 0.80 | FFAR4 (0.40) | GPBAR1PTGS1MAPTHPGDTSHR | |
| SCHEMBL10728790 | 0.79 | HPGD (0.43) | HPGDTSHRKMT2AALDH1A1FFAR4 | |
| SCHEMBL10661727 | 0.79 | CASP1 (0.44) | GPBAR1PTGS1ALDH1A1FFAR4NPC1 | |
| SCHEMBL10663342 | 0.78 | PKM (0.43) | GPBAR1PTGS1MAPTHPGDTSHR | |
| SCHEMBL10658060 | 0.78 | ALDH1A1 (0.42) | GPBAR1PTGS1MAPTHPGDTSHR | |
| SCHEMBL10665891 | 0.78 | GPBAR1 (0.36) | GPBAR1PTGS1MAPTTSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | disclosed |