Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FUCA1 | P04066 | 2/20 | 0.65 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.51 |
| ▸ | GBA1 | P04062 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL19680503 | 0.86 | ALDH1A1 (0.55) | FUCA1SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL19689038 | 0.86 | ALDH1A1 (0.55) | FUCA1SIGMAR1ALDH1A1KDM4E | |
| SCHEMBL8948752 | 0.82 | S1PR5 (0.54) | FUCA1SIGMAR1S1PR1S1PR5GRIN2B | |
| SCHEMBL19450643 | 0.81 | ACHE (0.61) | SIGMAR1KDM4E | |
| SCHEMBL16544830 | 0.81 | FUCA1 (0.55) | FUCA1SIGMAR1S1PR1S1PR5GBA1 | |
| SCHEMBL1860555 | 0.78 | FUCA1 (1.00) | FUCA1SIGMAR1S1PR1S1PR5GBA1 | |
| SCHEMBL7637770 | 0.78 | FUCA1 (1.00) | FUCA1SIGMAR1S1PR1S1PR5GBA1 | |
| SCHEMBL7637709 | 0.78 | FUCA1 (1.00) | FUCA1SIGMAR1S1PR1S1PR5GBA1 | |
| SCHEMBL84802 | 0.78 | FUCA1 (0.85) | FUCA1SIGMAR1S1PR1S1PR5GRIN2B | |
| SCHEMBL71063 | 0.78 | FUCA1 (0.85) | FUCA1SIGMAR1S1PR1S1PR5GRIN2B |
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-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 |
| EP-0165636-B1 | PROCESS FOR PREPARING AZETIDINE DERIVATIVES AND INTERMEDIATES THEREIN | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1988-08-10 | — | — | EP | disclosed |
| EP-0165636-A1 | Process for preparing azetidine derivatives and intermediates therein | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1985-12-27 | — | — | EP | disclosed |