Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MITF | O75030 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28256506 | 0.88 | PTPN1 (0.54) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL29832008 | 0.84 | PTPN1 (0.48) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL7580361 | 0.77 | L3MBTL1 (0.59) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL31433430 | 0.76 | POLB (0.48) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL9903761 | 0.76 | L3MBTL1 (0.57) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL7640661 | 0.76 | LMNA (0.49) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL29832463 | 0.75 | NTSR1 (0.49) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL29831753 | 0.75 | NTSR1 (0.43) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL29832039 | 0.75 | LMNA (0.46) | PTPN1ALDH1A1SMN1; SMN2MITFATM | |
| SCHEMBL29832000 | 0.75 | HSP90AA1 (0.42) | PTPN1ALDH1A1SMN1; SMN2MITFATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-115093367-A | Preparation method and application of fluoroalkyl ketone compound | 华南农业大学 | 2022-09-23 | — | — | CN | disclosed |