Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
| ▸ | FBP1 | P09467 | 1/20 | 0.30 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15915347 | 0.83 | — | — | |
| SCHEMBL3165747 | 0.82 | SLC1A5 (0.43) | SLC1A5 | |
| SCHEMBL5541804 | 0.79 | SLC1A5 (0.33) | SLC1A5 | |
| SCHEMBL13876906 | 0.78 | SLC6A2 (0.48) | S1PR4 | |
| SCHEMBL96147 | 0.78 | RAB9A (0.45) | CYP2C19S1PR4 | |
| SCHEMBL15915111 | 0.78 | CA2 (0.39) | CYP2C19 | |
| SCHEMBL15158671 | 0.77 | ACHE (0.46) | CYP2C19S1PR4 | |
| SCHEMBL3789460 | 0.77 | KIF11 (0.41) | CYP2C19 | |
| SCHEMBL9272920 | 0.76 | DRD2 (0.34) | S1PR4 | |
| SCHEMBL3802892 | 0.75 | CYP3A4 (0.48) | — |
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-6583139-B1 | Treatment of inflammatory diseases; inflammatory brain diseases such as multiple sclerosis; N-(Toluene-4-sulfonyl)-L-prolyl-4-(alpha -methylbenzyloxy)-L-phenylalanine; Very Late Antigen 4 | BIOGEN IDEC INTERNATIONAL HOLDING LTD. (BM) | 2003-06-24 | — | — | US | disclosed |