Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL9693595 | 0.82 | DPP4 (0.37) | MMECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9321495 | 0.82 | DPP4 (0.37) | MMECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL15479086 | 0.77 | CYP1A2 (0.42) | CYP1A2OPRK1ALPIPKMPTGS1 | |
| SCHEMBL27337151 | 0.77 | MME (0.49) | MMECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL23123157 | 0.76 | SIGMAR1 (0.43) | CYP1A2CYP2D6OPRK1 | |
| SCHEMBL27400575 | 0.76 | TRPA1 (0.44) | CYP1A2CYP3A4ALPIPKMPTGS1 | |
| SCHEMBL8837439 | 0.73 | MME (0.49) | MMECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL859558 | 0.73 | ALPI (0.55) | MMECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1337302 | 0.73 | ALPI (0.55) | MMECYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL838962 | 0.73 | CYP1A2 (0.63) | MMECYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5674864-A | ANALGESICS; ENDOPEPTIDASE AND ENKEPHALINASE INHIBITORS; CARDIOTONIC, PSYCHOTROPIC AND HYPERTENSIVE AGENTS | ROUSSEL UCLAF (FR) | 1997-10-07 | — | — | US | disclosed |
| US-5190974-A | Analgesics | ROUSSEL UCLAF (FR) | 1993-03-02 | — | — | US | disclosed |