Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.58 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.58 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | DRD2 | P14416 | 1/20 | 0.58 |
| ▸ | TACR2 | P21452 | 1/20 | 0.58 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.58 |
| ▸ | DRD3 | P35462 | 1/20 | 0.58 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.58 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.58 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.58 |
| ▸ | HTR2B | P41595 | 1/20 | 0.58 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
| ▸ | CACNA1S | Q13698 | 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 | |
|---|---|---|---|---|
| SCHEMBL7269413 | 0.98 | CYP3A4 (0.57) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7268650 | 0.85 | CYP3A4 (0.44) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7335261 | 0.85 | CYP3A4 (0.42) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7267594 | 0.84 | CCR1 (0.43) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7276455 | 0.84 | CCR1 (0.47) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7337080 | 0.84 | CYP3A4 (0.57) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL14065823 | 0.83 | CYP3A4 (0.60) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL8711773 | 0.82 | CYP3A4 (0.59) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7292129 | 0.82 | CYP3A4 (0.64) | CYP3A4ABCC3ABCC4CACNA1FABCB11 | |
| SCHEMBL7275439 | 0.81 | CYP3A4 (0.41) | CYP3A4ABCC3ABCC4CACNA1FABCB11 |
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-0831826-A1 | PHARMACEUTICAL COMPOSITION COMPRISING A PROTEINASE INHIBITOR AND A MONOGLYCERIDE | F. HOFFMANN-LA ROCHE AG (CH) | 1998-04-01 | — | — | EP | disclosed |
| WO-1996039142-A1 | PHARMACEUTICAL COMPOSITION COMPRISING A PROTEINASE INHIBITOR AND A MONOGLYCERIDE | F. HOFFMANN-LA ROCHE AG (CH) | 1996-12-12 | — | — | WO | disclosed |