Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | EEF2K | O00418 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | PDE6A | P16499 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | MC3R | P41968 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7343396 | 1.00 | CYP1A2 (0.45) | CYP1A2CYP2D6TSHRKMT2AMEN1 | |
| SCHEMBL7337002 | 1.00 | CYP1A2 (0.45) | CYP1A2CYP2D6TSHRKMT2AMEN1 | |
| SCHEMBL7339633 | 0.99 | CYP1A2 (0.46) | CYP1A2CYP2D6TSHRKMT2AMEN1 | |
| SCHEMBL7344285 | 0.95 | CYP2D6 (0.47) | CYP1A2CYP2D6TSHRKMT2AKCNH2 | |
| SCHEMBL7339207 | 0.90 | CYP2D6 (0.49) | CYP1A2CYP2D6TSHRKMT2AMEN1 | |
| SCHEMBL7339933 | 0.87 | CYP1A2 (0.42) | CYP1A2CYP2D6TSHRKMT2AKCNH2 | |
| SCHEMBL7348192 | 0.85 | DRD4 (0.47) | CYP1A2CYP2D6TSHRKMT2AMEN1 | |
| SCHEMBL7342120 | 0.85 | DRD4 (0.45) | CYP1A2CYP2D6TSHRKMT2AMEN1 | |
| SCHEMBL7342001 | 0.85 | CYP1A2 (0.41) | CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL7337729 | 0.84 | TSHR (0.50) | CYP1A2CYP2D6TSHRKMT2AMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0598962-B1 | Imidazole derivatives as calcium channel blockers | NEUROSEARCH AS (DK) | 1999-02-17 | — | — | EP | claimed |
| 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 |