Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CPN1 | P15169 | 1/20 | 0.31 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | CPA1 | P15085 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3632774 | 0.76 | GABRA1 (0.40) | EPHX1 | |
| SCHEMBL2266099 | 0.73 | SHBG (0.32) | — | |
| SCHEMBL3509472 | 0.72 | CYP2C9 (0.47) | CYP2C9CYP2C19HIF1ACPN1CPB2 | |
| Cyclohexane SCHEMBL16341926 | 0.71 | CYP2C9 (0.50) | CYP2C9CYP2C19HIF1ACPN1CPB2 | |
| Cyclohexane SCHEMBL7426845 | 0.71 | CYP2C9 (0.50) | CYP2C9CYP2C19HIF1ACPN1CPB2 | |
| SCHEMBL13711836 | 0.71 | CYP2C9 (0.50) | CYP2C9CYP2C19HIF1ACPN1CPB2 | |
| Cyclohexane SCHEMBL253223 | 0.71 | CYP2C9 (0.50) | CYP2C9CYP2C19HIF1ACPN1CPB2 | |
| Cyclohexane SCHEMBL6631080 | 0.71 | CYP2C9 (0.50) | CYP2C9CYP2C19HIF1ACPN1CPB2 | |
| SCHEMBL1547844 | 0.71 | SHBG (0.33) | — | |
| SCHEMBL506450 | 0.71 | CYP2C9 (0.50) | CYP2C9CYP2C19HIF1ACPN1CPB2 |
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-2155687-A1 | DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS | Via Pharmaceuticals, Inc. (US) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008141976-A1 | DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS | VIA PHARMACEUTICALS, INC. (US) | 2008-11-27 | — | — | WO | disclosed |