Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | CCR3 | P51677 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8925096 | 0.84 | ABCG2 (0.38) | MAOBMAOAHTR1ACALM1 | |
| SCHEMBL6886568 | 0.82 | AOC3 (0.34) | — | |
| SCHEMBL7462090 | 0.81 | CYP3A4 (0.33) | — | |
| SCHEMBL63619 | 0.73 | AOC3 (0.35) | — | |
| SCHEMBL6570928 | 0.66 | HTR2A (0.42) | MAOBMAOASIGMAR1 | |
| SCHEMBL161183 | 0.66 | ABCG2 (0.39) | — | |
| SCHEMBL8939757 | 0.65 | MAOA (0.42) | MAOBMAOASIGMAR1 | |
| SCHEMBL3404505 | 0.64 | ABCG2 (0.37) | — | |
| SCHEMBL451456 | 0.64 | MAOA (0.74) | MAOBMAOASIGMAR1 | |
| SCHEMBL7421641 | 0.64 | HTR2A (0.40) | MAOAHTR1ASIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5516797-A | SUPPRESSING GRAFT REJECTION | VERTEX PHARMACEUTICALS, INCORPORATED (US) | 1996-05-14 | — | — | US | disclosed |
| US-5330993-A | Immunosuppressive compounds | VERTEX PHARMACEUTICALS, INC. (US) | 1994-07-19 | — | — | US | disclosed |