Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | BRD2 | P25440 | 1/20 | 0.34 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108916 | 1.00 | MAOA (0.37) | MAOAACHEKDRCYP17A1CYP19A1 | |
| SCHEMBL30108760 | 0.95 | MAOA (0.37) | MAOAACHEKDRCYP17A1CYP19A1 | |
| SCHEMBL24379605 | 0.88 | SCN9A (0.42) | MAOACYP19A1ALPLSCN9AMAPK1 | |
| SCHEMBL29874759 | 0.88 | SCN9A (0.42) | MAOACYP19A1ALPLSCN9AMAPK1 | |
| SCHEMBL30108774 | 0.86 | MAOA (0.36) | MAOACYP17A1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL28934436 | 0.85 | ACHE (0.41) | ACHECRHR1POLBSMN1; SMN2SCN9A | |
| SCHEMBL31673746 | 0.85 | MAOA (0.37) | MAOAACHEKDRCYP17A1CRHR1 | |
| SCHEMBL26134941 | 0.85 | MAOA (0.37) | MAOAACHEKDRCYP17A1CYP19A1 | |
| SCHEMBL28934464 | 0.84 | MAPT (0.40) | ACHECRHR1POLBSMN1; SMN2MEN1 | |
| SCHEMBL24379596 | 0.83 | SCN9A (0.40) | MAOACYP17A1CYP19A1CYP11B1CYP11B2 |
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-2023183943-A1 | PYRIDO-[3,4-D]PYRIDAZINE AMINE DERIVATIVES USEFUL AS NLRP3 DERIVATIVES | VENTUS THERAPEUTICS U.S., INC. (US) | 2023-09-28 | — | — | WO | disclosed |