Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMAD3 | P84022 | 1/20 | 0.97 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.76 |
| ▸ | MEN1 | O00255 | 3/20 | 0.76 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.71 |
| ▸ | TSHR | P16473 | 5/20 | 0.70 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.70 |
| ▸ | MAPT | P10636 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.70 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.69 |
| ▸ | ACP1 | P24666 | 2/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.64 |
| ▸ | METAP1 | P53582 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.62 |
| ▸ | USP2 | O75604 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL1084399 | 1.00 | SMAD3 (0.97) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL1083847 | 1.00 | SMAD3 (0.97) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL1083756 | 0.99 | SMAD3 (1.00) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL1083839 | 0.88 | SMAD3 (0.80) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL31612794 | 0.86 | MEN1 (1.00) | SMAD3KMT2AMEN1TSHRL3MBTL1 | |
| SCHEMBL1084048 | 0.86 | SMAD3 (0.78) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL1083844 | 0.86 | SMAD3 (0.78) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL1084053 | 0.86 | MEN1 (1.00) | SMAD3KMT2AMEN1TSHRL3MBTL1 | |
| SCHEMBL1083982 | 0.85 | SMAD3 (0.76) | SMAD3KMT2AMEN1HIF1ATSHR | |
| SCHEMBL1083863 | 0.85 | SMAD3 (0.76) | SMAD3KMT2AMEN1HIF1ATSHR |
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 |