Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 4/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.35 |
| ▸ | PGR | P06401 | 6/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4864334 | 1.00 | ADRA1D (0.35) | ADRA1DADRA1AADRA1BPGRNR3C1 | |
| SCHEMBL4564297 | 0.93 | PGR (0.35) | PGRROCK2 | |
| SCHEMBL4555633 | 0.93 | PGR (0.38) | PGRNR3C1ROCK2 | |
| SCHEMBL4566784 | 0.91 | RARA (0.43) | PGRAVPR1A | |
| SCHEMBL4859401 | 0.90 | PGR (0.35) | PGRNR3C1HCRTR1HCRTR2 | |
| SCHEMBL4609216 | 0.90 | CACNA1B (0.35) | PGR | |
| SCHEMBL4565861 | 0.90 | MAPT (0.34) | PGRNR3C1ROCK2AKT1 | |
| SCHEMBL4861218 | 0.89 | PGR (0.42) | PGR | |
| SCHEMBL14146879 | 0.89 | PGR (0.42) | PGR | |
| SCHEMBL4864199 | 0.88 | PDE4A (0.39) | ROCK2AVPR1AAKT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1907395-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2008-04-09 | — | — | EP | disclosed |
| WO-2007002867-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2007-01-04 | — | — | WO | disclosed |