Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 11/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL25954907 | 0.85 | SLC22A12 (0.73) | SLC22A12CYP2C9CYP3A4ALDH1A1PTGS2 | |
| SCHEMBL25954963 | 0.83 | SLC22A12 (0.73) | SLC22A12CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL25954968 | 0.83 | SLC22A12 (1.00) | SLC22A12CYP2C9CYP1A2 | |
| SCHEMBL25954960 | 0.83 | SLC22A12 (0.70) | SLC22A12CYP2C9CYP1A2ALDH1A1PTGS2 | |
| SCHEMBL25954969 | 0.82 | SLC22A12 (0.69) | SLC22A12CYP2C9CYP1A2ALDH1A1MEN1 | |
| SCHEMBL25955218 | 0.81 | SLC22A12 (0.68) | SLC22A12CYP2C9CYP1A2TSHRSMN1; SMN2 | |
| SCHEMBL25955011 | 0.81 | SLC22A12 (0.65) | SLC22A12CYP2C9CYP3A4CYP1A2 | |
| SCHEMBL25955009 | 0.80 | SLC22A12 (0.67) | SLC22A12CYP2C9CYP1A2KMT2A | |
| SCHEMBL25955226 | 0.80 | SLC22A12 (0.79) | SLC22A12CYP2C9CYP1A2 | |
| SCHEMBL25955232 | 0.76 | SLC22A12 (0.61) | SLC22A12CYP2C9CYP1A2 |
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-2023143034-A1 | PYRIDOIMIDAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 山东大学 | 2023-08-03 | — | — | WO | disclosed |