Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 4/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.49 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9813328 | 0.80 | CHRNB2 (0.46) | CHRNB2CHRNB4CHRNA3CHRNA4MAPK8 | |
| SCHEMBL9813335 | 0.77 | MAPK8 (0.45) | CNR2MAPK8MAPK9ADORA1ADORA3 | |
| SCHEMBL9813368 | 0.77 | CHRNB2 (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4MAPK8 | |
| SCHEMBL9813347 | 0.75 | CHRNB2 (0.53) | CHRNB2CHRNB4CHRNA3CHRNA4CNR1 | |
| SCHEMBL15968991 | 0.74 | RAB9A (0.61) | MAPK8MAPK9ADORA1ADORA3SMN1; SMN2 | |
| SCHEMBL15305700 | 0.70 | SMN1; SMN2 (0.58) | ADORA1ADORA3SMN1; SMN2RAB9AL3MBTL1 | |
| SCHEMBL15969466 | 0.70 | ADORA1 (0.50) | MAPK8MAPK9ADORA1ADORA3SMN1; SMN2 | |
| SCHEMBL9854270 | 0.69 | MAOA (0.43) | ALDH1A1LMNAMAPT | |
| SCHEMBL24738246 | 0.68 | SMN1; SMN2 (0.58) | ADORA1ADORA3SMN1; SMN2RAB9AL3MBTL1 | |
| SCHEMBL28337675 | 0.68 | KMT2A (0.47) | CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2 |
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-0434576-A1 | Thermotropic adducts from non-mesogenic species bound by hydrogen bonds and method for their preparation | RHONE-POULENC CHIMIE (FR) | 1991-06-26 | — | — | EP | disclosed |