Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL7307298 | 0.85 | CYP1A2 (0.33) | MAPTRIPK1ALOX15 | |
| SCHEMBL7317206 | 0.83 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4EHTTRIPK1 | |
| SCHEMBL1080987 | 0.82 | CYP2D6 (0.37) | ALDH1A1MAPK1RIPK1ALOX15 | |
| SCHEMBL7311082 | 0.77 | AKT1 (0.36) | ALDH1A1MAPTKDM4EHTT | |
| SCHEMBL7311089 | 0.77 | AKT1 (0.36) | ALDH1A1MAPTKDM4EHTT | |
| SCHEMBL7306684 | 0.73 | BACE1 (0.31) | — | |
| SCHEMBL29077157 | 0.73 | KIF11 (0.35) | ALDH1A1MAPK1ALOX15 | |
| SCHEMBL7309814 | 0.73 | ALDH1A1 (0.38) | ALDH1A1TSHRMAPTKDM4EHTT | |
| SCHEMBL7307231 | 0.72 | CYP2C19 (0.38) | ALDH1A1MAPK1MAPT | |
| SCHEMBL7309620 | 0.72 | TAAR1 (0.36) | ALDH1A1TSHRHTT |
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 |