Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 11/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6889972 | 0.80 | KCNH2 (0.39) | L3MBTL1ALDH1A1HSD17B10MAPT | |
| SCHEMBL6570928 | 0.76 | HTR2A (0.42) | MAOAMAOBSIGMAR1 | |
| SCHEMBL140371 | 0.72 | ADRA1A (0.40) | L3MBTL1 | |
| SCHEMBL10894648 | 0.72 | KCNH2 (0.49) | SIGMAR1ALDH1A1HSD17B10 | |
| SCHEMBL6468704 | 0.72 | KCNH2 (0.45) | SIGMAR1L3MBTL1 | |
| SCHEMBL8939752 | 0.71 | ADRA1D (0.42) | MAOASIGMAR1L3MBTL1 | |
| SCHEMBL451456 | 0.71 | MAOA (0.74) | MAOAMAOBSIGMAR1L3MBTL1ALDH1A1 | |
| SCHEMBL5332631 | 0.70 | KCNH2 (0.40) | SIGMAR1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL6294089 | 0.69 | MAOA (0.48) | MAOAMAOBSIGMAR1L3MBTL1MAPT | |
| SCHEMBL6161864 | 0.69 | — | — |
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 |