Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 7/20 | 0.48 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1084435 | 0.88 | SCN9A (0.49) | CHEK2SMAD3KMT2AMEN1MAPT | |
| SCHEMBL1084865 | 0.88 | SCN9A (0.49) | CHEK2SMAD3KMT2AMEN1MAPT | |
| SCHEMBL1084748 | 0.87 | SCN9A (0.51) | CHEK2SMAD3KMT2AMEN1MAPT | |
| SCHEMBL1083955 | 0.87 | SCN9A (0.51) | CHEK2SMAD3KMT2AMEN1MAPT | |
| SCHEMBL1084871 | 0.85 | CHEK2 (0.42) | CHEK2SMAD3KMT2AMEN1MAPT | |
| SCHEMBL1084873 | 0.84 | CHEK2 (0.46) | CHEK2SMAD3KMT2AMEN1CHEK1 | |
| SCHEMBL1083980 | 0.81 | NR1I2 (0.48) | CHEK2SMAD3KMT2AMEN1CHEK1 | |
| SCHEMBL1084594 | 0.81 | CHEK2 (0.46) | CHEK2SMAD3KMT2AMEN1CHEK1 | |
| SCHEMBL1084208 | 0.81 | MAPT (0.58) | CHEK2SMAD3KMT2AMEN1MAPT | |
| SCHEMBL1084134 | 0.81 | SMAD3 (0.47) | CHEK2SMAD3KMT2AMEN1CHEK1 |
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 6 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 |
| US-8153642-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-04-10 | — | — | US | disclosed |
| US-7713983-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-05-11 | — | — | US | disclosed |
| US-7713983-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-05-11 | — | — | US | disclosed |
| US-7678802-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-16 | — | — | US | disclosed |