Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | AADAT | Q8N5Z0 | 3/20 | 0.35 |
| ▸ | XIAP | P98170 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.33 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GOT1 | P17174 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.33 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4415567 | 0.74 | SMN1; SMN2 (0.42) | CYP2D6CYP2C9SMN1; SMN2AADATXIAP | |
| SCHEMBL30396025 | 0.70 | SMN1; SMN2 (0.46) | CYP2D6CYP2C9SMN1; SMN2ALDH1A1P2RX4 | |
| SCHEMBL5000976 | 0.70 | SMN1; SMN2 (0.46) | CYP2D6CYP2C9SMN1; SMN2ALDH1A1P2RX4 | |
| SCHEMBL7324240 | 0.67 | MEN1 (0.57) | CYP2C9SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL38660167 | 0.67 | ALDH1A1 (0.41) | CYP2D6CYP2C9SMN1; SMN2AADATXIAP | |
| SCHEMBL28227456 | 0.67 | ALDH1A1 (0.41) | CYP2D6CYP2C9SMN1; SMN2AADATXIAP | |
| SCHEMBL4422532 | 0.66 | CYP2D6 (0.58) | CYP2D6CYP2C9SMN1; SMN2AADATXIAP | |
| SCHEMBL4422526 | 0.66 | CYP2D6 (0.58) | CYP2D6CYP2C9SMN1; SMN2AADATXIAP | |
| SCHEMBL4415354 | 0.66 | SMN1; SMN2 (0.57) | CYP2D6CYP2C9SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL7688831 | 0.66 | SMN1; SMN2 (0.57) | CYP2D6CYP2C9SMN1; SMN2ALDH1A1MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0320136-B1 | Imidazoquinoxaline compounds and their preparation and use | NOVO NORDISK AS (DK) | 1994-07-27 | — | — | EP | disclosed |
| US-4999354-A | Central Nervous System Disorders, Anticonvulsant and Anxiolytic Agents | A/S FERROSAN (DK) | 1991-03-12 | — | — | US | disclosed |
| US-4968682-A | CENTRAL NERVOUS SYSTEM DISORDERS | A/S FERROSAN (DK) | 1990-11-06 | — | — | US | disclosed |
| EP-0320136-A2 | Imidazoquinoxaline compounds and their preparation and use | NOVO NORDISK A/S (DK) | 1989-06-14 | — | — | EP | disclosed |