Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 6/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945111 | 0.91 | MEN1 (0.46) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL31164010 | 0.88 | ALDH1A1 (0.47) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL338845 | 0.86 | CHRM1 (0.62) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL31164013 | 0.82 | DNM1 (0.50) | ADRA1ALMNAACHE | |
| SCHEMBL8945377 | 0.81 | CHRM5 (0.50) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL31164016 | 0.81 | RAD52 (0.54) | ADRA1ALMNATSHRACHE | |
| Choline SCHEMBL9298326 | 0.79 | RAD52 (0.49) | ADRA1ALMNAACHE | |
| SCHEMBL10059085 | 0.79 | CHRM5 (0.74) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL10643358 | 0.78 | CHRM5 (0.44) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL22687659 | 0.77 | CHRM5 (0.46) | CHRM5CHRM1CHRM3CHRM2CHRM4 |
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-5489663-A | TRIMERIZING ALIPHATIC AND/OR CYCLOALIPHATIC DIISOCYANATES USING TETRAALKYLAMMONIUM ALKYL CARBONATE OR MIXTURES WITH QUATERNARY AMMONIOALKYL CARBONATE CATALYSTS, DEACTIVATING CATALYST | BASF AKTIENGESELLSCHAFT (DE) | 1996-02-06 | — | — | US | disclosed |