Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.41 |
| ▸ | GPR3 | P46089 | 1/20 | 0.40 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TOP1 | P11387 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28907992 | 0.87 | KIF11 (0.46) | KIF11BACE1PTGDR2GPR3NPBWR1 | |
| SCHEMBL29669657 | 0.87 | KIF11 (0.46) | KIF11BACE1PTGDR2GPR3NPBWR1 | |
| SCHEMBL29669727 | 0.82 | ADORA2A (0.46) | KIF11ALDH1A1ADORA2AADORA1TSHR | |
| SCHEMBL21040615 | 0.81 | KIF11 (0.52) | KIF11BACE1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL30595031 | 0.79 | GPR3 (0.38) | KIF11GPR3HPGD | |
| SCHEMBL29125569 | 0.79 | GPR3 (0.38) | KIF11GPR3HPGD | |
| SCHEMBL27621380 | 0.79 | KIF11 (0.44) | KIF11BACE1PTGDR2GPR3FABP4 | |
| SCHEMBL25060874 | 0.78 | HSP90AA1 (0.43) | KIF11ALDH1A1TSHRRAB9A | |
| SCHEMBL30954769 | 0.78 | ALDH1A1 (0.45) | KIF11ALDH1A1ADORA2AADORA1TSHR | |
| SCHEMBL29141880 | 0.78 | ALDH1A1 (0.39) | KIF11GPR3NPBWR1ALDH1A1TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112876507-B | Trisubstituted olefin tertiary phosphine compound and preparation method thereof | 湖北大学 | 2022-08-30 | — | — | CN | disclosed |
| CN-112876507-A | Trisubstituted olefin tertiary phosphine compound and preparation method thereof | 湖北大学 | 2021-06-01 | — | — | CN | disclosed |
| CN-109851635-B | Novel alkylated monophosphine ligand and simple preparation method thereof | 湖北大学 | 2021-03-16 | — | — | CN | disclosed |
| CN-112250709-A | Synthesis method of ortho-aryl substituted tertiary phosphine compound | 湖北大学 | 2021-01-22 | — | — | CN | disclosed |
| CN-109851635-A | A kind of new alkylation monophosphorus ligand and its simple preparation method | 湖北大学 | 2019-06-07 | — | — | CN | disclosed |