Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 3/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | LSS | P48449 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3192106 | 0.96 | CHRNA7 (0.45) | CHRNA7HTR3EHTR3BCHRNB2CHRNA4 | |
| Fumaric Acid SCHEMBL3192099 | 0.78 | LSS (0.44) | LSS | |
| Fumaric Acid SCHEMBL1542888 | 0.78 | LSS (0.44) | LSS | |
| Fumaric Acid SCHEMBL5420562 | 0.76 | CHRNA7 (0.50) | CHRNA7LSSBCHEACHECHRM2 | |
| Fumaric Acid SCHEMBL5420571 | 0.76 | CHRNA7 (0.50) | CHRNA7LSSBCHEACHECHRM2 | |
| Fumaric Acid SCHEMBL1542469 | 0.76 | GYS1 (0.46) | CHRNA7HTR3EHTR3BCHRNB2CHRNA4 | |
| Fumaric Acid SCHEMBL1542464 | 0.76 | GYS1 (0.46) | CHRNA7HTR3EHTR3BCHRNB2CHRNA4 | |
| Fumaric Acid SCHEMBL1020193 | 0.74 | LSS (0.53) | CHRNA7LSSBCHEACHEMEN1 | |
| SCHEMBL5650254 | 0.74 | LSS (0.57) | CHRNA7LSSBCHEACHEMEN1 | |
| SCHEMBL5420568 | 0.72 | CHRM2 (0.50) | CHRNA7LSSBCHEACHECHRM2 |
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-2308875-A1 | Fused bicycloheterocycle substituted quinuclidine derivatives as .alpha.7 nAChR modulators | Abbott Laboratories (US) | 2011-04-13 | — | — | EP | disclosed |