Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9617801 | 1.00 | CHRNB2 (0.40) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL9729443 | 0.80 | ALDH1A1 (0.39) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL9852593 | 0.75 | MAPT (0.39) | ALDH1A1SMN1; SMN2MAPTKDM4EGAA | |
| SCHEMBL7638475 | 0.74 | CHRNB2 (0.43) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7638479 | 0.74 | CHRNB2 (0.43) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL2958531 | 0.73 | CHRNB2 (0.41) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL2958535 | 0.73 | CHRNB2 (0.41) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7036880 | 0.72 | CHRNB2 (0.42) | CHRNB2CHRNA4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7662055 | 0.71 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2MAPTKDM4EGAA | |
| SCHEMBL9843035 | 0.71 | CHRNB2 (0.37) | CHRNB2CHRNA4ALDH1A1CYP3A4CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4059763-A | — | — | None | — | — | JP | disclosed |
| JP-H0459763-A | GUANIDINE DERIVATIVE, PRODUCTION AND PHARMACEUTICAL THEREOF | TAKEDA CHEM IND LTD | 1992-02-26 | — | — | JP | disclosed |