Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.38 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8000279 | 0.85 | KMT2A (0.43) | PPARGHTR2AHTR2CPARP1MAPT | |
| SCHEMBL7988658 | 0.83 | PPARG (0.44) | PPARGMAPTPOLBTSHRCYP2C19 | |
| SCHEMBL8001632 | 0.77 | MAPT (0.48) | PPARGMAPTLMNAMAOB | |
| SCHEMBL7988653 | 0.77 | MAOB (0.41) | PPARGMAPTKMT2ALMNAMAOB | |
| SCHEMBL8004163 | 0.75 | TSHR (0.42) | PPARGMAPTPOLBTSHRCYP2C19 | |
| SCHEMBL28179497 | 0.74 | TTR (0.59) | PARP1MAPTRECQLPOLBCYP3A4 | |
| SCHEMBL8002290 | 0.74 | MAOB (0.47) | MAPTKMT2AMAOB | |
| SCHEMBL8001633 | 0.74 | NFE2L2 (0.50) | PPARGMAPTCYP3A4HSD17B10KMT2A | |
| SCHEMBL7998748 | 0.74 | CYP19A1 (0.41) | PPARGMAPTPOLBKMT2ALMNA | |
| SCHEMBL7988661 | 0.70 | PPARG (0.49) | PPARGMAPTTSHRL3MBTL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009120783-A1 | HIGH AFFINITY INHIBITORS OF HEPATITIS C VIRUS NS3/4A PROTEASE | THE JOHNS HOPKINS UNIVERSITY (US) | 2009-10-01 | — | — | WO | disclosed |