Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMAD3 | P84022 | 1/20 | 0.53 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13433804 | 0.98 | SMAD3 (0.53) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL13433800 | 0.92 | SMAD3 (0.50) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL13434117 | 0.89 | SMAD3 (0.53) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL1084371 | 0.87 | SMAD3 (0.56) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL1623718 | 0.86 | SMAD3 (0.55) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL1623958 | 0.86 | SMAD3 (0.55) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL1084884 | 0.86 | SMAD3 (0.55) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL1623723 | 0.86 | SMAD3 (0.55) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL28943748 | 0.86 | SMAD3 (0.55) | SMAD3CHEK2KMT2AMEN1MAPT | |
| SCHEMBL27714002 | 0.86 | SMAD3 (0.55) | SMAD3CHEK2KMT2AMEN1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7678802-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-16 | — | — | US | disclosed |