Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL12679974 | 0.89 | ALDH1A1 (0.46) | GCGRALDH1A1TSHRTRPA1LMNA | |
| SCHEMBL12679970 | 0.89 | GCGR (0.52) | GCGRALDH1A1TSHRLMNAMAPT | |
| SCHEMBL30671670 | 0.83 | PDE4A (0.39) | GCGRALDH1A1TSHRTRPA1LMNA | |
| SCHEMBL10320031 | 0.81 | GCGR (0.50) | GCGRALDH1A1TSHRLMNAMAPT | |
| SCHEMBL30539355 | 0.78 | GCGR (0.45) | GCGRALDH1A1TSHRLMNAMAPT | |
| SCHEMBL5499337 | 0.77 | ALDH1A1 (0.43) | ALDH1A1TSHRTRPA1LMNAMAPT | |
| SCHEMBL29083603 | 0.72 | GCGR (0.41) | GCGRTSHRLMNAMAPTHTT | |
| SCHEMBL5501718 | 0.72 | ALDH1A1 (0.44) | ALDH1A1TSHRTRPA1PTPN1GSK3B | |
| SCHEMBL7905342 | 0.71 | GCGR (0.42) | GCGRALDH1A1TSHRLMNAMAPT | |
| SCHEMBL28260306 | 0.71 | GCGR (0.42) | GCGRALDH1A1TSHRLMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-116813666-A | Phosphine ligand compound with benzyl alcohol group and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-116813451-A | Substituted benzyl alcohol compound and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-09-29 | — | — | CN | disclosed |