Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLQ | O75417 | 1/20 | 0.50 |
| ▸ | PYGL | P06737 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | LIPE | Q05469 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL15551126 | 0.84 | POLQ (0.51) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL5143941 | 0.84 | POLQ (0.51) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL18766032 | 0.83 | POLQ (0.50) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL14350966 | 0.83 | POLQ (0.50) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL8278748 | 0.81 | POLQ (0.49) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL6644466 | 0.80 | CYP2D6 (0.46) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL16353933 | 0.80 | POLQ (0.48) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL18765715 | 0.80 | SMN1; SMN2 (0.56) | POLQPYGLCYP2C19CYP2D6POLB | |
| SCHEMBL2558035 | 0.80 | MEN1 (0.50) | CYP2C19POLBKMT2AMEN1TSHR | |
| SCHEMBL5862092 | 0.80 | MEN1 (0.60) | POLQPOLBKMT2AMEN1TSHR |
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-2011132048-A1 | HETEROARYL COMPOUNDS AS PDE10A INHIBITORS | GLENMARK PHARMACEUTICAL S.A. (CH) | 2011-10-27 | — | — | WO | disclosed |