Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.50 |
| ▸ | CNR2 | P34972 | 3/20 | 0.50 |
| ▸ | PPARD | Q03181 | 10/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9978071 | 0.80 | CNR1 (0.53) | CNR1CNR2PPARDPOLBNPC1 | |
| SCHEMBL9978149 | 0.80 | CNR1 (0.53) | CNR1CNR2PPARDPOLBKDM4E | |
| SCHEMBL9978007 | 0.79 | CNR1 (0.52) | CNR1CNR2PPARDPOLBNPC1 | |
| SCHEMBL9937870 | 0.78 | POLB (0.51) | CNR1CNR2PPARDPOLBNPC1 | |
| SCHEMBL9978037 | 0.78 | CNR1 (0.51) | CNR1CNR2PPARDPOLBKDM4E | |
| SCHEMBL9978065 | 0.78 | CNR1 (0.50) | CNR1CNR2PPARDPOLBKDM4E | |
| SCHEMBL9937741 | 0.78 | CNR1 (0.50) | CNR1CNR2PPARDALDH1A1NPC1 | |
| SCHEMBL9978072 | 0.77 | CNR1 (0.49) | CNR1CNR2PPARDPOLBALDH1A1 | |
| SCHEMBL9978092 | 0.76 | CNR1 (0.55) | CNR1CNR2PPARDPOLB | |
| SCHEMBL9978045 | 0.76 | CNR1 (0.48) | CNR1CNR2PPARDPOLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012079164-A1 | ACTIVATORS OF CYLINDRICAL PROTEASES | THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) | 2012-06-21 | — | — | WO | disclosed |