Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | 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 |
| ▸ | HPGD | P15428 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.44 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21604844 | 1.00 | TRPC1 (0.52) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL31252546 | 0.86 | KDM4E (0.56) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL6180211 | 0.86 | KDM4E (0.56) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL1402810 | 0.86 | TRPC1 (0.62) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL30147621 | 0.85 | TRPC1 (0.56) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL21604958 | 0.85 | TRPC1 (0.56) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL30147292 | 0.82 | MALT1 (0.48) | ALDH1A1KDM4EMAPTTDP1POLB | |
| SCHEMBL21604960 | 0.82 | TRPC1 (0.59) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL21604941 | 0.80 | KDM4E (0.51) | TRPC1TRPC3STIM1ORAI1STIM2 | |
| SCHEMBL30147895 | 0.80 | KDM4E (0.51) | TRPC1TRPC3STIM1ORAI1STIM2 |
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 |