Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MARS1 | P56192 | 7/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1011336 | 0.88 | CNR1 (0.49) | MARS1CYP1A2KMT2APTGS2ABCB1 | |
| SCHEMBL3819281 | 0.76 | MARS1 (0.54) | MARS1CYP1A2HIF1AKMT2APTGS2 | |
| SCHEMBL971737 | 0.76 | PTGS2 (0.56) | MARS1CYP1A2HIF1AKMT2APTGS2 | |
| SCHEMBL1011938 | 0.75 | MARS1 (0.41) | MARS1KMT2APTGS2CNR1PTGS1 | |
| SCHEMBL969917 | 0.71 | CNR2 (0.58) | CNR1CNR2 | |
| SCHEMBL1011590 | 0.70 | MARS1 (0.50) | MARS1CYP1A2HIF1AKMT2APTGS2 | |
| SCHEMBL1009295 | 0.70 | MARS1 (0.48) | MARS1CYP1A2HIF1AKMT2APTGS2 | |
| SCHEMBL9179149 | 0.70 | CYP1A2 (0.51) | CYP1A2HIF1AKMT2APTGS2ABCB1 | |
| SCHEMBL11868715 | 0.70 | RAD52 (0.68) | MARS1CYP1A2HIF1AKMT2ATP53 | |
| SCHEMBL11865536 | 0.70 | RAD52 (0.61) | MARS1CYP1A2KMT2ATP53CNR1 |
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-2094706-B1 | SUBSTITUTED 2,5-DFFLYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS | SANOFI AVENTIS (FR) | 2011-01-05 | — | — | EP | disclosed |