Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 1/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.42 |
| ▸ | RXRA | P19793 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PDE1A | P54750 | 2/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | VNN1 | O95497 | 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 | |
|---|---|---|---|---|
| SCHEMBL15865881 | 0.83 | ALOX5AP (0.50) | ALOX5APGRIN1GRIN2BRXRAHDAC6 | |
| SCHEMBL13559933 | 0.81 | CXCR4 (0.50) | ALOX5APGRIN1GRIN2BRXRARAB9A | |
| SCHEMBL13559731 | 0.79 | ALOX5AP (0.50) | ALOX5APGRIN1GRIN2BRXRANPC1 | |
| SCHEMBL8224027 | 0.77 | HDAC3 (0.55) | NPC1RAB9AHDAC6HDAC1MEN1 | |
| SCHEMBL13559904 | 0.76 | ALOX5AP (0.47) | ALOX5APGRIN1GRIN2BRXRANPC1 | |
| SCHEMBL19117565 | 0.71 | NPC1 (0.61) | NPC1RAB9AHDAC6HDAC1MEN1 | |
| SCHEMBL12536038 | 0.70 | NPSR1 (0.41) | ALOX5APCXCR4ADORA2BCYP3A4 | |
| SCHEMBL22804342 | 0.68 | HDAC6 (0.78) | HDAC6HDAC1HDAC4 | |
| SCHEMBL18503030 | 0.68 | NPC1 (0.47) | GRIN1GRIN2BRXRANPC1RAB9A | |
| SCHEMBL26482966 | 0.67 | RAB9A (0.44) | GRIN1GRIN2BRXRANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2635566-B1 | BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION | BOEHRINGER INGELHEIM INT (DE) | 2018-05-16 | — | — | EP | disclosed |