Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 2/20 | 0.35 |
| ▸ | RET | P07949 | 6/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLQ | O75417 | 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 | |
|---|---|---|---|---|
| SCHEMBL20389670 | 0.84 | ALDH1A1 (0.38) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL23533607 | 0.82 | ALDH1A1 (0.38) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL14726450 | 0.81 | GAA (0.47) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL16346977 | 0.80 | ALDH1A1 (0.45) | ALDH1A1 | |
| SCHEMBL19641656 | 0.79 | GAA (0.44) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL17377535 | 0.79 | GAA (0.44) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL20100162 | 0.78 | CYP4F2 (0.40) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL3433705 | 0.77 | CNR1 (0.38) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL21187505 | 0.77 | GAA (0.43) | GAACYP4F2CYP4A11ALDH1A1LMNA | |
| SCHEMBL24103620 | 0.77 | GAA (0.43) | GAACYP4F2CYP4A11ALDH1A1LMNA |
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-2024091573-A1 | CLOSED-LOOP OPTIMIZATION OF GENERAL REACTION CONDITIONS FOR HETEROARYL SUZUKI-MIYAURA COUPLING | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2024-05-02 | — | — | WO | disclosed |