Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.77 |
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.77 |
| ▸ | MEN1 | O00255 | 6/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.77 |
| ▸ | TSHR | P16473 | 2/20 | 0.77 |
| ▸ | GFER | P55789 | 1/20 | 0.77 |
| ▸ | NPC1 | O15118 | 9/20 | 0.72 |
| ▸ | MAPT | P10636 | 8/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.72 |
| ▸ | STAT1 | P42224 | 1/20 | 0.72 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.67 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.67 |
| ▸ | RELA | Q04206 | 2/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | TP53 | P04637 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL30229798 | 0.88 | RAB9A (0.84) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL537890 | 0.88 | RAB9A (0.83) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL14132986 | 0.87 | RAB9A (1.00) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL1143708 | 0.84 | RAB9A (1.00) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL28516248 | 0.84 | RAB9A (0.77) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL30229823 | 0.84 | RAB9A (0.77) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL28358100 | 0.84 | RAB9A (1.00) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL15727491 | 0.82 | RAB9A (0.73) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL30229663 | 0.81 | RAB9A (0.73) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL1144023 | 0.80 | RAB9A (0.71) | RAB9ASMN1; SMN2MEN1KMT2AALDH1A1 |
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-114031556-B | Synthetic method for preparing 5-amino-N-aryl-3-arylpyrazole compound by green one-pot method | 温州大学 | 2023-03-31 | — | — | CN | disclosed |