Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PREP | P48147 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL31382277 | 0.96 | HSD17B10 (0.42) | NR1H2NR1H3PARP1HSD17B10NPC1 | |
| SCHEMBL31218800 | 0.93 | PARP1 (0.40) | NR1H2NR1H3PARP1HSD17B10OPRK1 | |
| SCHEMBL30181867 | 0.89 | HSD17B10 (0.43) | PARP1HSD17B10NPC1ALDH1A1 | |
| SCHEMBL8569713 | 0.89 | HSD17B10 (0.43) | PARP1HSD17B10NPC1ALDH1A1 | |
| SCHEMBL28291821 | 0.89 | HSD17B10 (0.42) | NR1H2NR1H3HSD17B10OPRK1HPGD | |
| SCHEMBL29264620 | 0.88 | PARP1 (0.43) | NR1H2NR1H3PARP1HSD17B10OPRK1 | |
| SCHEMBL18428250 | 0.88 | NR1H2 (0.43) | NR1H2NR1H3HSD17B10OPRK1HPGD | |
| SCHEMBL30032926 | 0.85 | NR1H2 (0.43) | NR1H2NR1H3HSD17B10OPRK1HPGD | |
| SCHEMBL23654034 | 0.83 | HSD17B10 (0.45) | NR1H2NR1H3HSD17B10HPGDPREP | |
| SCHEMBL993785 | 0.83 | CCR5 (0.38) | PARP1HSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0871628-A1 | QUINOLIZINONE TYPE COMPOUNDS | Abbott Laboratories (US) | 1998-10-21 | — | — | EP | disclosed |
| US-5726182-A | TREATMENT OF BACTERIAL INFECTIONS | ABBOTT LABORATORIES (US) | 1998-03-10 | — | — | US | disclosed |
| US-5599816-A | BACTERICIDE | ABBOTT LABORATORIES (US) | 1997-02-04 | — | — | US | disclosed |
| WO-1996039407-A1 | QUINOLIZINONE TYPE COMPOUNDS | ABBOTT LABORATORIES (US) | 1996-12-12 | — | — | WO | disclosed |