Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 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 | |
|---|---|---|---|---|
| SCHEMBL20534746 | 0.91 | CHRNB2 (0.45) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL22529835 | 0.82 | CHRNB2 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL6650593 | 0.80 | CHRNB2 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL3868314 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL38651897 | 0.75 | MLYCD (0.50) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL19418096 | 0.75 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL8813059 | 0.75 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL6453719 | 0.75 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL8813051 | 0.75 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 | |
| SCHEMBL6424007 | 0.74 | NSD2 (0.43) | KMT2AMEN1NPC1CHRM2CHRM1 |
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-2018188962-A1 | SUBSTITUTED OXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI | BASF SE (DE) | 2018-10-18 | — | — | WO | disclosed |