Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 4/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 2/20 | 0.35 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11093077 | 0.76 | MAPK1 (0.44) | MAPK1NR1H2NR1H3GPR119RXRA | |
| SCHEMBL11087217 | 0.75 | HDAC1 (0.35) | MAPK1NR1H2NR1H3GPR119ABCB1 | |
| SCHEMBL11074159 | 0.74 | NR1H2 (0.44) | MAPK1NR1H2NR1H3GPR119RXRA | |
| SCHEMBL1632144 | 0.74 | MAPK1 (0.41) | MAPK1NR1H2GPR119 | |
| SCHEMBL11076333 | 0.70 | MAPK1 (0.42) | MAPK1NR1H2NR1H3GPR119RXRA | |
| SCHEMBL9949115 | 0.70 | OPRL1 (0.50) | MAPK1CCR5 | |
| SCHEMBL17108482 | 0.69 | RORC (0.43) | MAPK1NR1H2NR1H3CCR5USP30 | |
| SCHEMBL9948870 | 0.67 | GRIN2B (0.40) | MAPK1NR1H2NR1H3RXRACCR5 | |
| SCHEMBL11081833 | 0.67 | MEN1 (0.40) | MAPK1GPR119POLB | |
| SCHEMBL27652393 | 0.66 | POLB (0.39) | MAPK1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4483988-A | Substituted derivatives of 4-t-alkoxycarbonyl-piperazin-2-ones | RICHARDSON MERRELL INC. (US) | 1984-11-20 | — | — | US | disclosed |
| US-4435571-A | 5-(Substituted benzyl)-6-oxo-2-piperazine carboxylic acids and esters | RICHARDSON MERRELL INC. (US) | 1984-03-06 | — | — | US | disclosed |
| US-4341698-A | Enkaphalin derivatives | RICHARDSON-MERRELL INC. (US) | 1982-07-27 | — | — | US | disclosed |