Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28226587 | 0.85 | LMNA (0.41) | LMNAPTGS2CYP1A2CYP2C19NPC1 | |
| SCHEMBL28284102 | 0.85 | LMNA (0.41) | XDHLMNAPTGS2CYP1A2CYP2C19 | |
| SCHEMBL28226658 | 0.85 | PTGS2 (0.54) | LMNAPTGS2BRAFKDRCYP1A2 | |
| SCHEMBL28398226 | 0.85 | MEN1 (0.49) | LMNAPTGS2CYP1A2CYP2C19NPC1 | |
| SCHEMBL28395393 | 0.85 | MAPT (0.57) | LMNACYP1A2CYP2C19NPC1MAPT | |
| SCHEMBL244194 | 0.84 | MAPK1 (0.56) | LMNACYP1A2CYP2C19NPC1MAPT | |
| SCHEMBL28400665 | 0.82 | LMNA (0.65) | LMNAPTGS2NPC1MAPTRAB9A | |
| SCHEMBL28227470 | 0.82 | LOXL2 (0.42) | LMNAPTGS2CYP1A2CYP2C19NPC1 | |
| SCHEMBL14353427 | 0.81 | CYP1A2 (0.62) | XDHLMNAFLT3CYP1A2CYP2C19 | |
| SCHEMBL28393672 | 0.81 | NPY5R (0.41) | XDHLMNAPTGS2BRAFKDR |
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-114213329-B | Preparation method of aryl pyrazole compound | 中国农业科学院兰州畜牧与兽药研究所 | 2023-08-22 | — | — | CN | disclosed |