Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7344285 | 0.89 | CYP2D6 (0.47) | CYP1A2CYP2D6DRD4KMT2AOPRM1 | |
| SCHEMBL7339633 | 0.85 | CYP1A2 (0.46) | CYP1A2CYP2D6DRD4KMT2AMEN1 | |
| SCHEMBL7337002 | 0.84 | CYP1A2 (0.45) | CYP1A2CYP2D6DRD4KMT2AMEN1 | |
| SCHEMBL7343396 | 0.84 | CYP1A2 (0.45) | CYP1A2CYP2D6DRD4KMT2AMEN1 | |
| SCHEMBL7344115 | 0.84 | CYP1A2 (0.45) | CYP1A2CYP2D6DRD4KMT2AMEN1 | |
| SCHEMBL7342001 | 0.82 | CYP1A2 (0.41) | CYP1A2CYP2D6NR1H2NR1H3 | |
| SCHEMBL7339933 | 0.81 | CYP1A2 (0.42) | CYP1A2CYP2D6DRD4KMT2AOPRM1 | |
| SCHEMBL7339207 | 0.81 | CYP2D6 (0.49) | CYP1A2CYP2D6DRD4KMT2AMEN1 | |
| SCHEMBL7338728 | 0.80 | CYP1A2 (0.50) | CYP1A2CYP2D6DRD4KMT2AMEN1 | |
| SCHEMBL7342120 | 0.80 | DRD4 (0.45) | CYP1A2CYP2D6DRD4KMT2AMEN1 |
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 |