Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 8/20 | 0.39 |
| ▸ | LTB4R | Q15722 | 4/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7308792 | 0.83 | CYP2C19 (0.38) | KIF11CYP1A2CYP2D6CYP2C19HIF1A | |
| SCHEMBL2835140 | 0.72 | KIF11 (0.53) | KIF11LTB4R | |
| SCHEMBL14947069 | 0.68 | CYP1A2 (0.43) | KIF11APAF1CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL28006905 | 0.67 | KIF11 (0.53) | KIF11APAF1CYP1A2CYP2D6ALDH1A1 | |
| Bromide SCHEMBL9647545 | 0.66 | CYP1A2 (0.52) | LTB4RAPAF1CYP1A2CYP2D6BLM | |
| SCHEMBL1887342 | 0.66 | LTB4R (0.47) | KIF11LTB4R | |
| SCHEMBL1885698 | 0.66 | LTB4R (0.47) | KIF11LTB4R | |
| SCHEMBL15587062 | 0.65 | LTB4R (0.59) | LTB4RCYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL8826605 | 0.65 | LTB4R (0.59) | LTB4RCYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL3254192 | 0.65 | LTB4R (0.59) | LTB4RCYP2D6CYP2C19ALDH1A1 |
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 |