Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 7/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TAS2R14 | Q9NYV8 | 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 | |
|---|---|---|---|---|
| SCHEMBL18942071 | 0.77 | ALDH1A1 (0.54) | TDP1LDHAACHEPTPN1ALDH1A1 | |
| SCHEMBL11221835 | 0.76 | LDHA (0.66) | LDHAFFAR1POLB | |
| SCHEMBL28896648 | 0.75 | TDP1 (0.44) | NR1H3TDP1LDHAACHEPTPN1 | |
| SCHEMBL31392330 | 0.74 | APLNR (0.45) | ALDH1A1HTTSMN1; SMN2POLB | |
| SCHEMBL11221992 | 0.73 | LDHA (0.53) | LDHAALDH1A1HTTSMN1; SMN2FFAR1 | |
| SCHEMBL27200631 | 0.73 | MEP1B (0.60) | LDHAACHEALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL25401274 | 0.72 | TDP1 (0.53) | TDP1LDHAACHEALDH1A1HTT | |
| SCHEMBL25401270 | 0.72 | TDP1 (0.53) | TDP1LDHAACHEALDH1A1HTT | |
| SCHEMBL25241112 | 0.72 | POLB (0.48) | LDHAALDH1A1HTTSMN1; SMN2TSHR | |
| SCHEMBL25225718 | 0.72 | POLB (0.48) | LDHAALDH1A1HTTSMN1; SMN2TSHR |
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-115403584-A | 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-11-29 | — | — | CN | disclosed |