Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL335773 | 0.83 | KCNN4 (0.37) | KIF11ALDH1A1ADRB2ADRB1ADRB3 | |
| SCHEMBL335541 | 0.72 | KMT2A (0.38) | ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL15538966 | 0.71 | KIF11 (0.41) | HSP90AA1KIF11CXCL8ALDH1A1ADRB2 | |
| SCHEMBL16795807 | 0.71 | KIF11 (0.41) | HSP90AA1KIF11CXCL8ALDH1A1ADRB2 | |
| SCHEMBL15540080 | 0.71 | KIF11 (0.41) | HSP90AA1KIF11CXCL8ALDH1A1ADRB2 | |
| SCHEMBL13626302 | 0.71 | PDK1 (0.41) | HSP90AA1HSP90AB1ALDH1A1NPC1RAB9A | |
| SCHEMBL2390487 | 0.70 | KCNN4 (0.44) | HSP90AA1HSP90AB1KIF11ALDH1A1ADRB2 | |
| SCHEMBL2364652 | 0.67 | ALDH1A1 (0.38) | KIF11ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL718301 | 0.67 | AKT1 (0.44) | NPC1RAB9A | |
| SCHEMBL27862119 | 0.67 | AKT1 (0.44) | NPC1RAB9A |
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-8097758-B2 | Isoserine derivatives for use as coagulation factor IXa inhibitors | SANOFI-AVENTIS (FR) | 2012-01-17 | — | — | US | disclosed |