Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.52 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.52 |
| ▸ | CHRNB3 | Q05901 | 3/20 | 0.52 |
| ▸ | CHRNA6 | Q15825 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | 0.92 | ALDH1A1 (0.57) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL25810399 | 0.92 | ALDH1A1 (0.63) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL25840964 | 0.90 | ALDH1A1 (0.67) | HPGDALDH1A1TSHRHSD11B1LMNA | |
| SCHEMBL17177244 | 0.89 | GRM5 (0.49) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL25843142 | 0.88 | HTT (0.51) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL21946875 | 0.88 | HPGD (0.44) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL25840976 | 0.87 | CHRNB2 (0.58) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL25810405 | 0.87 | TSHR (0.49) | HPGDALDH1A1TSHRHTTLMNA | |
| SCHEMBL19132805 | 0.84 | ALDH1A1 (0.44) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL17177147 | 0.82 | GRM5 (0.59) | HPGDCHRNB2CHRNA3CHRNA4CHRNB3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023125737-A1 | HETEROCYCLIC COMPOUNDS AND USE THEREOF | SILEXON AI TECHNOLOGY CO., LTD. (CN) | 2023-07-06 | — | — | WO | disclosed |
| 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 |