Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.37 |
| ▸ | CKS1B | P61024 | 1/20 | 0.37 |
| ▸ | SKP1 | P63208 | 1/20 | 0.37 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL27813336 | 0.84 | BTK (0.64) | BTKEPHX1GAACA1CA2 | |
| Ethoxycarbonyl Group SCHEMBL28252011 | 0.84 | GAA (0.43) | BTKEPHX1GAACA1CA2 | |
| SCHEMBL369297 | 0.84 | BTK (0.72) | BTKEPHX1GAACA1CA2 | |
| Ethoxycarbonyl Group SCHEMBL27819345 | 0.82 | BTK (0.46) | BTKEPHX1KMT2AL3MBTL1CTSK | |
| Methyl Alcohol SCHEMBL9686628 | 0.82 | BTK (0.70) | BTKEPHX1GAACA1CA2 | |
| Ethoxycarbonyl Group SCHEMBL27966494 | 0.82 | BTK (0.39) | BTKEPHX1GAACA1CA2 | |
| Bicarbonate SCHEMBL486564 | 0.81 | BTK (0.73) | BTKEPHX1GAACA1CA2 | |
| Formaldehyde SCHEMBL28082188 | 0.81 | BTK (0.68) | BTKEPHX1GAACA1CA2 | |
| Ethoxycarbonyl Group SCHEMBL27653498 | 0.81 | MAOB (0.40) | BTKEPHX1GAAKMT2AL3MBTL1 | |
| SCHEMBL1829584 | 0.81 | BTK (0.67) | BTKEPHX1GAACA1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107089985-B | Pyrrolo- [2,3-D] pyrimidine derivatives as Zhan Nasi associated kinase (JAK) inhibitor | 辉瑞大药厂 | 2019-06-07 | — | — | CN | disclosed |
| CN-107735087-A | Histone deacetylase inhibitors, compositions and methods of use thereof | CHDI基金会股份有限公司 | 2018-02-23 | — | — | CN | disclosed |
| CN-107089985-A | It is used as pyrrolo- [2,3 D] pyrimidine derivatives of Zhan Nasi associated kinases (JAK) inhibitor | 辉瑞大药厂 | 2017-08-25 | — | — | CN | disclosed |
| CN-105008362-B | Pyrrolo [2,3-D ] pyrimidine derivatives as janus-related kinase (JAK) inhibitors | 辉瑞大药厂 | 2017-06-06 | — | — | CN | disclosed |