Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 7/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.50 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.47 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.47 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15003944 | 1.00 | ALDH1A1 (0.62) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL5604987 | 0.85 | GAA (0.73) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL6376702 | 0.85 | GAA (0.73) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL1884341 | 0.85 | GAA (0.73) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL11207120 | 0.82 | ALDH1A1 (0.65) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL673127 | 0.82 | ALDH1A1 (0.67) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL3408275 | 0.82 | ALDH1A1 (0.65) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL10054998 | 0.81 | GAA (0.73) | ALDH1A1GAAMEN1KMT2AHTR7 | |
| SCHEMBL11205766 | 0.80 | ALDH1A1 (0.62) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL15137210 | 0.80 | ALDH1A1 (0.62) | ALDH1A1GAAMEN1KMT2AKDM4E |
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-0598962-A1 | Imidazole derivatives as calcium channel blockers | NEUROSEARCH A/S (DK) | 1994-06-01 | — | — | EP | disclosed |
| US-5296493-A | Analgesics or antiischemics | NEUROSEARCH A/S (DK) | 1994-03-22 | — | — | US | disclosed |