Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 2/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21760970 | 0.83 | SMN1; SMN2 (0.51) | SMN1; SMN2TSHRGLAALDH1A1GAA | |
| SCHEMBL21760975 | 0.82 | KMT2A (0.55) | SMN1; SMN2TSHRGLAALDH1A1CYP1A2 | |
| SCHEMBL21760973 | 0.80 | SMN1; SMN2 (0.51) | SMN1; SMN2TSHRGLAALDH1A1CYP1A2 | |
| SCHEMBL30016331 | 0.78 | SMN1; SMN2 (0.46) | SMN1; SMN2TSHRGLAALDH1A1GAA | |
| SCHEMBL29134947 | 0.77 | ALPL (0.58) | SMN1; SMN2GLAMAPTKMT2AMEN1 | |
| SCHEMBL21761089 | 0.76 | SMN1; SMN2 (0.67) | SMN1; SMN2TSHRGLAALDH1A1GAA | |
| SCHEMBL21761033 | 0.75 | SMN1; SMN2 (0.51) | SMN1; SMN2TSHRGLAALDH1A1GAA | |
| SCHEMBL21760972 | 0.73 | ALPL (0.60) | SMN1; SMN2TSHRGLAALDH1A1GAA | |
| SCHEMBL21761090 | 0.71 | SMN1; SMN2 (0.54) | SMN1; SMN2TSHRGLAALDH1A1GAA | |
| SCHEMBL21177215 | 0.71 | SMN1; SMN2 (0.56) | SMN1; SMN2TSHRGLAALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020040104-A1 | BICYCLIC HETEROAROMATIC RING DERIVATIVE | 杏林製薬株式会社 | 2020-02-27 | — | — | WO | disclosed |