Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 10/20 | 0.51 |
| ▸ | CNR1 | P21554 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1084350 | 0.89 | MAPT (0.55) | GBA1CNR1CNR2MAPTALDH1A1 | |
| SCHEMBL1084879 | 0.87 | MEN1 (0.49) | GBA1CNR1CNR2MAPTALDH1A1 | |
| SCHEMBL1084956 | 0.82 | MAPT (0.55) | GBA1CNR1CNR2MAPTALDH1A1 | |
| SCHEMBL1084751 | 0.79 | MAPT (0.47) | GBA1CNR1CNR2MAPT | |
| SCHEMBL1084897 | 0.79 | CYP1A2 (0.45) | GBA1CNR1CNR2MAPTCYP1A2 | |
| SCHEMBL1084421 | 0.78 | GBA1 (0.42) | GBA1CNR1CNR2 | |
| SCHEMBL1084799 | 0.77 | MEN1 (0.50) | GBA1CNR1CNR2MAPTALDH1A1 | |
| SCHEMBL1084617 | 0.75 | GBA1 (0.46) | GBA1CNR1CNR2MAPTALDH1A1 | |
| SCHEMBL1084402 | 0.75 | GBA1 (0.44) | GBA1CNR1CNR2 | |
| SCHEMBL1084608 | 0.75 | GBA1 (0.48) | GBA1CNR1CNR2MAPTTSHR |
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-8343980-B2 | Quinazoles useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-01-01 | — | — | US | disclosed |
| US-8343980-B2 | Quinazoles useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-01-01 | — | — | US | disclosed |