Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL8939699 | 0.83 | ADRA1D (0.39) | ADRA1DADRA1AADRA1BSIGMAR1MAOA | |
| SCHEMBL16954285 | 0.76 | IRAK4 (0.36) | ADRA1DADRA1AADRA1B | |
| SCHEMBL8093384 | 0.73 | ABCB1 (0.47) | ADRA1DADRA1AADRA1BSIGMAR1 | |
| SCHEMBL8939757 | 0.71 | MAOA (0.42) | SIGMAR1L3MBTL1MAOA | |
| SCHEMBL252640 | 0.70 | THRA (0.36) | — | |
| SCHEMBL6570928 | 0.69 | HTR2A (0.42) | ADRA1ASIGMAR1MAOA | |
| SCHEMBL140371 | 0.69 | ADRA1A (0.40) | ADRA1AL3MBTL1 | |
| SCHEMBL10894648 | 0.69 | KCNH2 (0.49) | SIGMAR1 | |
| SCHEMBL6468704 | 0.69 | KCNH2 (0.45) | SIGMAR1L3MBTL1 | |
| SCHEMBL7701983 | 0.68 | IRAK4 (0.42) | ADRA1DADRA1AADRA1B |
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 |