Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.68 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.68 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.68 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.68 |
| ▸ | HTT | P42858 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | PPARG | P37231 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.57 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.57 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.55 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1491954 | 0.86 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRNB4CHRNA3HTT | |
| SCHEMBL11994154 | 0.86 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRNB4CHRNA3HTT | |
| SCHEMBL11007801 | 0.85 | CHRNB2 (0.72) | CHRNB2CHRNA4CHRNB4CHRNA3HTT | |
| SCHEMBL8894839 | 0.85 | ALDH1A1 (0.62) | HTTALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL1649572 | 0.82 | CHRNB2 (0.68) | CHRNB2CHRNA4CHRNB4CHRNA3HTT | |
| SCHEMBL7217604 | 0.82 | CHRNB2 (0.68) | CHRNB2CHRNA4CHRNB4CHRNA3HTT | |
| SCHEMBL9695573 | 0.81 | HTT (0.63) | HTTALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL5849754 | 0.81 | HTT (0.63) | HTTALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL7611716 | 0.81 | CHRNB2 (0.61) | CHRNB2CHRNA4CHRNB4CHRNA3HTT | |
| SCHEMBL1826396 | 0.79 | CHRNB2 (0.65) | CHRNB2CHRNA4CHRNB4CHRNA3HTT |
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-5616798-A | 2,2',4,4'6,6'-HEXAAMIDO-3,3',5,5'-TETRAIODOBIPHENYLS; RADIOLOGY | GUERBET S.A. (FR) | 1997-04-01 | — | — | US | disclosed |