Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 3/20 | 0.60 |
| ▸ | SLCO1B1 | Q9Y6L6 | 3/20 | 0.60 |
| ▸ | HMGCR | P04035 | 3/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.60 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.60 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.60 |
| ▸ | RHOC | P08134 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.60 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.60 |
| ▸ | ABCC3 | O15438 | 2/20 | 0.58 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.58 |
| ▸ | SLCO1B3 | Q9NPD5 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL17547671 | 0.83 | HMGCR (0.87) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL12634444 | 0.83 | HMGCR (0.87) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL5514749 | 0.81 | HMGCR (0.75) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL28547123 | 0.79 | HMGCR (0.82) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL28547122 | 0.79 | HMGCR (0.82) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL684124 | 0.77 | HMGCR (0.79) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL5424116 | 0.77 | HMGCR (0.79) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL5066794 | 0.77 | HMGCR (0.71) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL24283536 | 0.76 | HMGCR (0.85) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 | |
| SCHEMBL13735238 | 0.76 | HMGCR (0.85) | ABCB11SLCO1B1HMGCRHDAC1HDAC2 |
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-RE40667-E1 | [R-(R*R*)]-2-(4-fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid, its lactone form and salts thereof | WARNER-LAMBERT COMPANY LLC (US) | 2009-03-17 | — | — | US | disclosed |