Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 4/20 | 0.47 |
| ▸ | ACACB | O00763 | 10/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.44 |
| ▸ | RARG | P13631 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.44 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8692120 | 1.00 | CYP2C9 (0.48) | CYP2C9CYP2C19ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL8861669 | 0.86 | LDHA (0.59) | CYP2C9CYP2C19POLBPPARAACACB | |
| SCHEMBL7431892 | 0.86 | LDHA (0.59) | CYP2C9CYP2C19POLBPPARAACACB | |
| SCHEMBL7432086 | 0.85 | PPARA (0.56) | CYP2C9CYP2C19ALDH1A1SMN1; SMN2PPARA | |
| SCHEMBL11247461 | 0.84 | ACACB (0.49) | CYP2C9CYP2C19ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL8861640 | 0.83 | PPARA (0.53) | CYP2C9CYP2C19PPARAACACBCYP1A2 | |
| SCHEMBL8694777 | 0.83 | PPARA (0.53) | CYP2C9CYP2C19PPARAACACBCYP1A2 | |
| SCHEMBL7435690 | 0.81 | CYP1A2 (0.46) | CYP2C9CYP2C19PPARACYP1A2CYP3A4 | |
| SCHEMBL838961 | 0.81 | CYP1A2 (0.63) | CYP2C9CYP2C19PPARACYP1A2CYP3A4 | |
| SCHEMBL838962 | 0.81 | CYP1A2 (0.63) | CYP2C9CYP2C19PPARACYP1A2CYP3A4 |
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-5599951-A | ENZYME INHIBITORS | SOCIETE CIVILE BIOPROJET (FR) | 1997-02-04 | — | — | US | disclosed |