Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 1/20 | 0.50 |
| ▸ | GPR119 | Q8TDV5 | 12/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NOTCH1 | P46531 | 1/20 | 0.46 |
| ▸ | STS | P08842 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SGMS1 | Q86VZ5 | 1/20 | 0.43 |
| ▸ | SGMS2 | Q8NHU3 | 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 | |
|---|---|---|---|---|
| SCHEMBL3135336 | 0.91 | NAMPT (0.44) | TGFBR1KDM4EGAAMAPT | |
| SCHEMBL1710759 | 0.89 | ACKR3 (0.45) | TGFBR1MAPT | |
| SCHEMBL8444736 | 0.84 | KDM4E (0.59) | TGFBR1GPR119KDM4EPKMSTS | |
| SCHEMBL1498332 | 0.84 | STS (0.49) | TGFBR1GPR119NOTCH1STSMAPT | |
| SCHEMBL20015333 | 0.82 | MAOB (0.57) | TGFBR1GPR119KDM4EPKMNOTCH1 | |
| SCHEMBL13279525 | 0.81 | GPR119 (0.63) | TGFBR1GPR119KDM4EPKMSGMS1 | |
| SCHEMBL18280017 | 0.81 | TGFBR1 (0.53) | TGFBR1GPR119KDM4EPKMNOTCH1 | |
| SCHEMBL5763005 | 0.80 | GPR119 (0.51) | GPR119KDM4EPKM | |
| SCHEMBL3043410 | 0.79 | GPR119 (0.46) | TGFBR1GPR119STSMAPT | |
| SCHEMBL6011556 | 0.79 | GPR119 (0.62) | GPR119KDM4EPKMMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2205083-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | Merck Sharp & Dohme Corp. (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009045382-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | MERCK & CO., INC. (US) | 2009-04-09 | — | — | WO | disclosed |