Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29380873 | 0.84 | CYP19A1 (0.35) | CYP19A1PDK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL1194744 | 0.84 | CYP19A1 (0.35) | CYP19A1PDK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL2157339 | 0.84 | TSHR (0.32) | SMN1; SMN2TSHR | |
| SCHEMBL30397781 | 0.80 | CYP19A1 (0.32) | CYP19A1DRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL23781890 | 0.77 | CYP19A1 (0.35) | CYP19A1LMNASMN1; SMN2ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL23781937 | 0.75 | — | — | |
| SCHEMBL23781985 | 0.74 | MAPK1 (0.38) | CYP19A1LMNASMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL29620290 | 0.73 | CYP19A1 (0.36) | CYP19A1PDK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL20345372 | 0.73 | CYP19A1 (0.37) | CYP19A1LMNASMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL17801510 | 0.72 | CYP19A1 (0.36) | CYP19A1LMNASMN1; SMN2ALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116171154-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-05-26 | — | — | CN | disclosed |