Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5066949 | 0.89 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL6389194 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL7554673 | 0.83 | TSHR (0.37) | ALDH1A1TSHRTP53CYP2D6CYP1A2 | |
| SCHEMBL5072084 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL6392514 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL8431662 | 0.79 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL1026465 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL14732603 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TSHRCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL14727189 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TSHRTDP1CHRNB2CHRNB4 | |
| SCHEMBL8745149 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TSHRCHRNB2CHRNB4CHRNA3 |
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-0462670-B1 | Use of 1-(1-pyrrolidinylcarbonyl)pyridinium salts to attach compounds to caboxylated particles & a kit containing same | JOHNSON & JOHNSON CLIN DIAG (US) | 1996-08-21 | — | — | EP | claimed |