Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.47 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28398944 | 0.87 | NPC1 (0.54) | MEN1KMT2ASMN1; SMN2GRM5MAPT | |
| SCHEMBL28400070 | 0.87 | GAA (0.50) | KDM4EMEN1KMT2AGRM5ALDH1A1 | |
| SCHEMBL28397870 | 0.86 | GRM5 (0.49) | SMN1; SMN2GRM5CYP2C19CYP1A2ALDH1A1 | |
| SCHEMBL30153272 | 0.86 | GRM5 (0.49) | SMN1; SMN2GRM5CYP2C19CYP1A2ALDH1A1 | |
| SCHEMBL28399770 | 0.85 | LMNA (0.48) | KDM4EMEN1KMT2ASMN1; SMN2GRM5 | |
| SCHEMBL28407311 | 0.84 | TSHR (0.54) | KDM4EMEN1KMT2ASMN1; SMN2GRM5 | |
| SCHEMBL28397875 | 0.84 | LMNA (0.58) | MEN1KMT2AMAPTTSHRGAA | |
| SCHEMBL13056035 | 0.80 | NQO2 (0.43) | MEN1KMT2ASMN1; SMN2MAPTTSHR | |
| SCHEMBL28398860 | 0.80 | RAB9A (0.49) | MEN1KMT2ASMN1; SMN2GRM5MAPT | |
| SCHEMBL28401280 | 0.80 | KDM4E (0.55) | KDM4EMEN1KMT2ASMN1; SMN2GRM5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111187215-B | Fluorine-containing pyrazole amide derivative, preparation method and application thereof | 西北农林科技大学 | 2023-02-24 | — | — | CN | disclosed |
| CN-111187215-A | Fluorine-containing pyrazole amide derivative, preparation method and application thereof | 西北农林科技大学 | 2020-05-22 | — | — | CN | disclosed |