Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.65 |
| ▸ | USP2 | O75604 | 5/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.65 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.65 |
| ▸ | ACP1 | P24666 | 4/20 | 0.63 |
| ▸ | KMT5A | Q9NQR1 | 2/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | RAD52 | P43351 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1085578 | 0.91 | CYP1A2 (0.79) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL1085090 | 0.83 | ACP1 (0.84) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL1085411 | 0.82 | ACP1 (0.87) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL31453017 | 0.80 | TLR9 (0.72) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL14259847 | 0.80 | ACP1 (0.69) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL1085427 | 0.78 | CYP1A2 (0.61) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL3460750 | 0.77 | ACP1 (0.74) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL14259846 | 0.76 | TLR9 (0.68) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL31612806 | 0.75 | CYP1A2 (0.66) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 | |
| SCHEMBL1085859 | 0.74 | ACP1 (0.71) | CYP1A2CYP3A4CYP2D6USP2HSD17B10 |
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 8 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-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 |
| US-7678802-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-16 | — | — | US | disclosed |