Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA3 | P15088 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.38 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | CPA1 | P15085 | 2/20 | 0.37 |
| ▸ | CPB1 | P15086 | 1/20 | 0.37 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15479086 | 0.83 | CYP1A2 (0.42) | CPA3CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL27400575 | 0.78 | TRPA1 (0.44) | CPA3CYP1A2FOLH1ALPIPKM | |
| SCHEMBL28103077 | 0.76 | CYP1A2 (0.36) | CPA3CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL23123157 | 0.75 | SIGMAR1 (0.43) | CYP1A2TRPA1EPHX1 | |
| SCHEMBL27574232 | 0.74 | CNR2 (0.42) | ACECPA1 | |
| SCHEMBL693020 | 0.73 | CYP1A2 (0.37) | CPA3CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL8837508 | 0.73 | MME (0.46) | CYP1A2ALPIPKMPTGS1XIAP | |
| Hydrochloric Acid SCHEMBL8837445 | 0.72 | EPHX1 (0.53) | CPA3CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL2808578 | 0.71 | CYP1A2 (0.52) | CPA3CYP1A2FOLH1ALPIPKM | |
| SCHEMBL4421756 | 0.71 | CYP1A2 (0.52) | CPA3CYP1A2FOLH1ALPIPKM |
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 |