Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.42 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.35 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.35 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.35 |
| ▸ | SMO | Q99835 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1621492 | 0.90 | CHEK2 (0.39) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL1623453 | 0.89 | MAPT (0.40) | KMT2AMEN1CHEK2SMAD3MAPT | |
| Hydrochloric Acid SCHEMBL1622253 | 0.88 | MAPT (0.39) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL1623016 | 0.87 | SMAD3 (0.38) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL1623021 | 0.87 | SMAD3 (0.38) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL12720942 | 0.84 | GPR119 (0.37) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL1623937 | 0.84 | GPR119 (0.37) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL1623933 | 0.84 | GPR119 (0.37) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL6110990 | 0.82 | KMT2A (0.49) | KMT2AMEN1CHEK2SMAD3MAPT | |
| SCHEMBL1623199 | 0.81 | TSHR (0.42) | KMT2AMEN1CHEK2SMAD3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-101068794-B | Quinazolines useful as modulators of ion channels | VERTEX PHARMA | 2012-12-19 | — | — | CN | disclosed |
| CN-101068794-A | Quinazolines useful as modulators of ion channels | VERTEX PHARMA (US) | 2007-11-07 | — | — | CN | disclosed |