Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL335772 | 0.84 | MEN1 (0.39) | ALDH1A1LMNAL3MBTL1GAA | |
| SCHEMBL4114108 | 0.81 | CXCL8 (0.41) | CASP1ADRB2ADRB1NPC1RAB9A | |
| SCHEMBL28573252 | 0.80 | HTT (0.44) | SMN1; SMN2ALDH1A1CYP2C19HTTGAA | |
| SCHEMBL28573250 | 0.80 | HTT (0.44) | SMN1; SMN2ALDH1A1CYP2C19HTTGAA | |
| SCHEMBL4633763 | 0.76 | CASP1 (0.54) | CASP1ADRB2ADRB1SMN1; SMN2ALDH1A1 | |
| SCHEMBL30290820 | 0.76 | CASP1 (0.54) | CASP1ADRB2ADRB1SMN1; SMN2ALDH1A1 | |
| SCHEMBL4633761 | 0.76 | CASP1 (0.54) | CASP1ADRB2ADRB1SMN1; SMN2ALDH1A1 | |
| SCHEMBL17753762 | 0.73 | L3MBTL1 (0.50) | ADRB2ADRB1NPC1RAB9AALOX12 | |
| SCHEMBL13584745 | 0.71 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1NPC1RAB9AKCNA5 | |
| SCHEMBL4543253 | 0.71 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1NPC1RAB9AKCNA5 |
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 |