Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 4/20 | 0.38 |
| ▸ | RET | P07949 | 7/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29771541 | 1.00 | ATR (0.38) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL31005998 | 0.84 | RXRA (0.39) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL31005979 | 0.84 | RXRA (0.39) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL24610343 | 0.83 | GAA (0.47) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL21198529 | 0.83 | GAA (0.47) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL21217456 | 0.82 | RET (0.37) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL21198696 | 0.81 | CYP4F2 (0.39) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL29388171 | 0.81 | ALDH1A1 (0.39) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL14863556 | 0.81 | ALDH1A1 (0.39) | ATRRETCYP4F2CYP4A11RXRA | |
| SCHEMBL22890853 | 0.80 | RET (0.37) | ATRRETCYP4F2CYP4A11RXRA |
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-2021007477-A1 | INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS | E-SCAPE BIO, INC. (US) | 2021-01-14 | — | — | WO | disclosed |