Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | EBP | Q15125 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | SLC47A1 | Q96FL8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7314859 | 0.77 | TBXA2R (0.35) | CYP2D6CYP3A4CYP2C19SLC22A2SLC22A1 | |
| SCHEMBL7310593 | 0.74 | EBP (0.51) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL5752959 | 0.74 | EBP (0.51) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL5756879 | 0.71 | CYP2D6 (0.37) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL5754563 | 0.71 | CYP2D6 (0.40) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL5754187 | 0.69 | CCR1 (0.40) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL7314781 | 0.69 | EBP (0.38) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL5755493 | 0.68 | DRD2 (0.37) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL5753670 | 0.68 | EBP (0.43) | CYP2D6CYP3A4DRD2DRD4OPRM1 | |
| SCHEMBL7304444 | 0.68 | CYP2D6 (0.34) | CYP2D6CYP3A4DRD2DRD4OPRM1 |
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-1041064-A2 | N-substituted alpha aminoacid amides as calcium channel modulators | ELI LILLY AND COMPANY LIMITED (GB) | 2000-10-04 | — | — | EP | disclosed |
| EP-0805147-A1 | Novel N-substituted alpha aminoacid amides as calcium channel modulators | LILLY INDUSTRIES LIMITED (GB) | 1997-11-05 | — | — | EP | disclosed |