Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.56 |
| ▸ | HPGD | P15428 | 7/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.56 |
| ▸ | GAA | P10253 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | TRPC1 | P48995 | 2/20 | 0.52 |
| ▸ | TRPC3 | Q13507 | 2/20 | 0.52 |
| ▸ | STIM1 | Q13586 | 2/20 | 0.52 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.52 |
| ▸ | STIM2 | Q9P246 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20265798 | 1.00 | KDM4E (0.56) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL10367010 | 0.90 | MAPT (0.57) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL21604777 | 0.89 | HPGD (0.58) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL30147821 | 0.89 | HPGD (0.58) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL30147864 | 0.87 | HPGD (0.56) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL21605054 | 0.87 | HPGD (0.56) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL21605120 | 0.86 | HPGD (0.56) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL30147886 | 0.86 | HPGD (0.56) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL21604814 | 0.83 | MAPT (0.57) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL21605015 | 0.83 | TRPC1 (0.53) | KDM4EHPGDALDH1A1CYP1A2CYP2C9 |
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-112585128-B | Pyrazole derivatives as MALT1 inhibitors | 詹森药业有限公司 | 2023-02-21 | — | — | CN | disclosed |