Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 7/20 | 0.41 |
| ▸ | CTSD | P07339 | 6/20 | 0.41 |
| ▸ | CCR2 | P41597 | 7/20 | 0.40 |
| ▸ | TACR2 | P21452 | 6/20 | 0.38 |
| ▸ | TACR1 | P25103 | 6/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5372924 | 1.00 | BACE1 (0.41) | BACE1CTSDCCR2TACR2TACR1 | |
| SCHEMBL5379624 | 1.00 | BACE1 (0.41) | BACE1CTSDCCR2TACR2TACR1 | |
| SCHEMBL5372919 | 1.00 | BACE1 (0.41) | BACE1CTSDCCR2TACR2TACR1 | |
| SCHEMBL5369028 | 0.83 | BACE1 (0.40) | BACE1CTSD | |
| SCHEMBL3353949 | 0.79 | BACE1 (0.49) | BACE1CTSD | |
| SCHEMBL3350144 | 0.79 | BACE1 (0.49) | BACE1CTSD | |
| SCHEMBL3353955 | 0.79 | BACE1 (0.49) | BACE1CTSD | |
| SCHEMBL3350134 | 0.79 | BACE1 (0.49) | BACE1CTSD | |
| SCHEMBL13307733 | 0.78 | BACE1 (0.51) | BACE1CTSD | |
| SCHEMBL13307731 | 0.78 | BACE1 (0.51) | BACE1CTSD |
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 |
|---|---|---|---|---|---|---|---|
| US-7176242-B2 | N,N′-substituted-1,3-diamino-2-hydroxypropane derivatives | ELAN PHARMACEUTICALS, INC. (US) | 2007-02-13 | — | — | US | disclosed |