Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 13/20 | 0.57 |
| ▸ | MEN1 | O00255 | 12/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.49 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.49 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13368709 | 0.86 | MAPT (0.59) | KMT2AMEN1MAPTRXFP1ALK | |
| SCHEMBL1084165 | 0.84 | CYP1A2 (0.70) | KMT2AMEN1HSD17B10CYP1A2CYP2D6 | |
| SCHEMBL1084777 | 0.84 | MEN1 (0.67) | KMT2AMEN1HSD17B10CYP1A2CYP2D6 | |
| SCHEMBL1084806 | 0.83 | MAPT (0.53) | KMT2AMEN1MAPTTDP1RXFP1 | |
| SCHEMBL4519746 | 0.83 | KMT2A (0.52) | KMT2AMEN1HSD17B10CYP1A2CYP2D6 | |
| SCHEMBL1084789 | 0.83 | KMT2A (0.52) | KMT2AMEN1MAPTMAPK1RXFP1 | |
| SCHEMBL1084783 | 0.82 | MAPT (0.78) | KMT2AMEN1MAPTRXFP1ALK | |
| SCHEMBL1084611 | 0.82 | KMT2A (0.53) | KMT2AMEN1MAPTRXFP1ALK | |
| SCHEMBL1084297 | 0.82 | KMT2A (0.51) | KMT2AMEN1MAPTMAPK1RXFP1 | |
| SCHEMBL1084168 | 0.82 | MEN1 (0.71) | KMT2AMEN1HSD17B10CYP1A2CYP2D6 |
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 4 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-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 |
| EP-1784393-B1 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2009-07-01 | — | — | EP | disclosed |