Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.42 |
| ▸ | CHRNB3 | Q05901 | 2/20 | 0.42 |
| ▸ | CHRNA6 | Q15825 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17809474 | 0.85 | ALDH1A1 (0.57) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL25810399 | 0.81 | ALDH1A1 (0.63) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL25840964 | 0.79 | ALDH1A1 (0.67) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL17177147 | 0.79 | GRM5 (0.59) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL25810478 | 0.79 | HPGD (0.46) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL25810394 | 0.76 | HPGD (0.56) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL1117898 | 0.75 | HPGD (0.81) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL3708786 | 0.75 | ALDH1A1 (0.73) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL25503911 | 0.75 | ALDH1A1 (0.60) | ALDH1A1TSHRGRM5HPGDHSD11B1 | |
| SCHEMBL12714626 | 0.73 | HPGD (0.86) | ALDH1A1TSHRGRM5HPGDHSD11B1 |
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-2023116763-A1 | PYRIDAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | 上海优理惠生医药有限公司 | 2023-06-29 | — | — | WO | disclosed |