Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | SCN4A | P35499 | 2/20 | 0.55 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CCR3 | P51677 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27478430 | 0.91 | KDM4E (0.62) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL12716627 | 0.89 | S1PR5 (0.58) | MEN1KMT2ASCN4AS1PR5ACHE | |
| SCHEMBL13270667 | 0.85 | SCN4A (0.53) | MEN1KMT2ASCN4AS1PR5ACHE | |
| SCHEMBL5567542 | 0.84 | SCN4A (0.62) | MEN1KMT2ASCN4AS1PR5ACHE | |
| SCHEMBL12174911 | 0.84 | SCN4A (0.62) | MEN1KMT2ASCN4AS1PR5ACHE | |
| SCHEMBL12174984 | 0.84 | SCN4A (0.62) | MEN1KMT2ASCN4AS1PR5ACHE | |
| SCHEMBL27441592 | 0.81 | S1PR5 (0.64) | MEN1KMT2ASCN4AS1PR5ALDH1A1 | |
| SCHEMBL250506 | 0.81 | S1PR5 (0.77) | MEN1KMT2ASCN4AS1PR5ALDH1A1 | |
| SCHEMBL16301219 | 0.81 | S1PR5 (0.77) | MEN1KMT2ASCN4AS1PR5ALDH1A1 | |
| SCHEMBL9037650 | 0.81 | S1PR5 (0.77) | MEN1KMT2ASCN4AS1PR5ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3253752-B1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES INC (US) | 2023-08-16 | — | — | EP | disclosed |