Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | VSIR | Q9H7M9 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.34 |
| ▸ | CALML3 | P27482 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | SDHA | P31040 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17760457 | 0.90 | MAOA (0.41) | MAOACD274CALML3LMNAPTGS1 | |
| SCHEMBL1393660 | 0.88 | MAOA (0.56) | MAOACALML3LMNAPTGS1MAOB | |
| SCHEMBL17760112 | 0.83 | MAOA (0.42) | MAOACALML3LMNAPTGS1MAOB | |
| SCHEMBL17760212 | 0.80 | MAOA (0.40) | MAOAALDH1A1BACE1CALML3LMNA | |
| SCHEMBL17760208 | 0.80 | MAOA (0.41) | MAOACALML3LMNAPTGS1MAOB | |
| SCHEMBL17760069 | 0.78 | MAOA (0.41) | MAOACALML3LMNAPTGS1MAOB | |
| SCHEMBL1393366 | 0.77 | MAOA (0.58) | MAOACALML3LMNAPTGS1MAOB | |
| SCHEMBL17760912 | 0.75 | RAB9A (0.46) | MAOAALDH1A1LMNA | |
| SCHEMBL17760184 | 0.74 | MAOA (0.38) | MAOACD274PDCD1CALML3LMNA | |
| SCHEMBL1394187 | 0.73 | MAOA (0.58) | MAOACALML3LMNAPTGS1MAOB |
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-2016077818-A1 | METHOD FOR TREATING, PREVENTING, OR REDUCING THE RISK OF SKIN INFECTION | MELINTA THERAPEUTICS, INC. (US) | 2016-05-19 | — | — | WO | disclosed |