Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29848982 | 1.00 | ALDH1A1 (0.53) | ALDH1A1SCN2ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL6556194 | 0.83 | SCN2A (0.51) | ALDH1A1SCN2AMEN1KMT2AKDM4E | |
| SCHEMBL9773949 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KMT2A | |
| SCHEMBL29236534 | 0.80 | ALDH1A1 (0.51) | ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL29236536 | 0.80 | ALDH1A1 (0.51) | ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL29236529 | 0.79 | CASP3 (0.53) | ALDH1A1SMN1; SMN2KMT2ANPC1KDM4E | |
| SCHEMBL29236527 | 0.79 | CASP3 (0.53) | ALDH1A1SMN1; SMN2KMT2ANPC1KDM4E | |
| SCHEMBL10603968 | 0.78 | KMT2A (0.69) | ALDH1A1SCN2ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL29236538 | 0.77 | RPS6KA2 (0.52) | ALDH1A1SMN1; SMN2MEN1KMT2ANPC1 | |
| SCHEMBL29236539 | 0.77 | RPS6KA2 (0.52) | ALDH1A1SMN1; SMN2MEN1KMT2ANPC1 |
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-114874143-A | Regulator containing pyrazole derivatives, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-08-09 | — | — | CN | disclosed |