Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 7/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.41 |
| ▸ | SLCO1B1 | Q9Y6L6 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | RHOC | P08134 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.40 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.40 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9756772 | 0.92 | HMGCR (0.48) | HMGCRABCB11SLCO1B1NR1I2RHOC | |
| SCHEMBL9756757 | 0.89 | HMGCR (0.56) | HMGCRESR1CHRM1TBXA2RPDE4A | |
| SCHEMBL9521415 | 0.84 | HMGCR (0.54) | HMGCRABCB11ESR1CHRM1TBXA2R | |
| SCHEMBL9518920 | 0.83 | HMGCR (0.67) | HMGCR | |
| SCHEMBL9320893 | 0.83 | HMGCR (0.41) | HMGCRABCB11ESR1CHRM1TBXA2R | |
| SCHEMBL9318925 | 0.82 | HMGCR (0.49) | HMGCRESR1CHRM1TBXA2RPDE4A | |
| SCHEMBL6949668 | 0.80 | NR4A2 (0.45) | HMGCRABCB11NR1I2ESR1CHRM1 | |
| SCHEMBL9756770 | 0.79 | HMGCR (0.54) | HMGCRABCB11TBXA2RADRA1AABCC3 | |
| SCHEMBL9025442 | 0.79 | HMGCR (0.40) | HMGCRESR1CHRM1TBXA2RPDE4A | |
| SCHEMBL9025434 | 0.79 | HMGCR (0.40) | HMGCRESR1CHRM1TBXA2RPDE4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0287890-A1 | Substituted pyrroles | BAYER AG (DE) | 1988-10-26 | — | — | EP | disclosed |