Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 9/20 | 0.38 |
| ▸ | CCR2 | P41597 | 8/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16093927 | 0.87 | ALDH1A1 (0.38) | TACR1NPC1 | |
| SCHEMBL16100467 | 0.84 | GRIN2B (0.41) | — | |
| SCHEMBL16100249 | 0.82 | MEN1 (0.37) | NPC1 | |
| SCHEMBL16099623 | 0.82 | TACR1 (0.39) | TACR1 | |
| SCHEMBL16094524 | 0.80 | TACR1 (0.34) | TACR1 | |
| SCHEMBL16094187 | 0.80 | BTK (0.38) | NPC1 | |
| SCHEMBL16099914 | 0.78 | ENPP2 (0.41) | — | |
| SCHEMBL16093646 | 0.77 | ENPP2 (0.40) | TACR1 | |
| SCHEMBL17509125 | 0.76 | CCR2 (0.36) | TACR1CCR2 | |
| SCHEMBL16093608 | 0.76 | ENPP2 (0.44) | TACR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014152725-A1 | S1P AND/OR ATX MODULATING AGENTS | BIOGEN IDEC MA INC. (US) | 2014-09-25 | — | — | WO | disclosed |