Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP1 | O94782 | 1/20 | 0.53 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 13/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 11/20 | 0.50 |
| ▸ | TSHR | P16473 | 9/20 | 0.50 |
| ▸ | LMNA | P02545 | 5/20 | 0.50 |
| ▸ | USP2 | O75604 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL802127 | 0.89 | CYP1A2 (0.48) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL14393588 | 0.89 | CYP1A2 (0.48) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL1083862 | 0.89 | USP1 (0.48) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13107395 | 0.88 | CYP1A2 (0.47) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL785479 | 0.84 | CYP1A2 (0.61) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL801910 | 0.83 | FADS1 (0.47) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL801930 | 0.82 | MEN1 (0.45) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL786005 | 0.82 | CYP1A2 (0.60) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10266745 | 0.82 | MEN1 (0.45) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL801927 | 0.82 | MEN1 (0.64) | LMNAALDH1A1MAPK1SMN1; SMN2MEN1 |
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 |