Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | PRCP | P42785 | 1/20 | 0.40 |
| ▸ | MASP2 | O00187 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4237630 | 1.00 | SLC18A3 (0.55) | SLC18A3SIGMAR1KMT2AMEN1AKR1C3 | |
| SCHEMBL29148914 | 0.87 | SLC18A3 (0.43) | SLC18A3SIGMAR1KMT2AMEN1SLC6A2 | |
| SCHEMBL30711259 | 0.86 | AKR1C3 (0.44) | SLC18A3SIGMAR1AKR1C3AKR1C1SLC6A2 | |
| SCHEMBL8129145 | 0.81 | SLC18A3 (0.41) | SLC18A3SIGMAR1KMT2AMEN1SLC6A2 | |
| SCHEMBL25076786 | 0.80 | GRIN2B (0.47) | KMT2AMEN1SLC6A2MASP2HPGD | |
| SCHEMBL29213808 | 0.80 | GRIN2B (0.47) | KMT2AMEN1SLC6A2MASP2HPGD | |
| SCHEMBL25076785 | 0.80 | GRIN2B (0.47) | KMT2AMEN1SLC6A2MASP2HPGD | |
| SCHEMBL5011948 | 0.80 | SLC18A3 (0.55) | SLC18A3SIGMAR1KMT2AAKR1C3AKR1C1 | |
| SCHEMBL6072153 | 0.79 | HDAC2 (0.46) | SLC18A3SIGMAR1KMT2AMEN1AKR1C3 | |
| SCHEMBL24365527 | 0.78 | SLC18A3 (0.39) | SLC18A3SIGMAR1KMT2AMEN1CHRNB2 |
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-2398789-B1 | SPIROPYRROLIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK SHARP & DOHME (US) | 2014-03-19 | — | — | EP | disclosed |