Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18736915 | 0.79 | CHRNB2 (0.45) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL6497498 | 0.79 | CHRNB2 (0.45) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL20501494 | 0.77 | CHRNB2 (0.43) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL12845027 | 0.77 | MAPK1 (0.46) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL17035462 | 0.76 | CHRNB2 (0.42) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL14330807 | 0.76 | CHRNB2 (0.42) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL13660651 | 0.74 | CYP2D6 (0.41) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL5247568 | 0.74 | NFKB1 (0.41) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL18737201 | 0.74 | CHRNB2 (0.41) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 | |
| SCHEMBL5244895 | 0.74 | CHRNB2 (0.41) | CHRNB2CHRNA4NFKB1CHRM2CHRM4 |
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-7655251-B2 | Amphiphilic derivatives of α-C-phenyl-N-tert-butylnitrone | TS PHARMA (FR) | 2010-02-02 | — | — | US | disclosed |