Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 1/20 | 0.47 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.47 |
| ▸ | ITK | Q08881 | 2/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1111552 | 0.86 | IMPDH2 (0.51) | IMPDH2IMPDH1DGAT1SOAT1KCNH2 | |
| SCHEMBL21754663 | 0.83 | IMPDH2 (0.47) | IMPDH2IMPDH1ITKDRD2DRD4 | |
| SCHEMBL897218 | 0.80 | L3MBTL1 (0.56) | IMPDH2IMPDH1ITKDRD2DRD4 | |
| SCHEMBL17351203 | 0.78 | RHEB (0.36) | IMPDH2IMPDH1DGAT1SOAT1KCNH2 | |
| SCHEMBL14823132 | 0.77 | KDM4E (0.56) | ITKKIF11KDM4E | |
| SCHEMBL27659521 | 0.74 | DAO (0.49) | ITKNR3C1PGRNR3C2KDM4E | |
| SCHEMBL2977967 | 0.73 | KDM4E (0.53) | KIF11KDM4E | |
| SCHEMBL17351229 | 0.73 | AHR (0.47) | ITKNOS1KDM4E | |
| SCHEMBL21822137 | 0.73 | IMPDH2 (0.47) | IMPDH2IMPDH1ITKDRD2DRD4 | |
| SCHEMBL5728507 | 0.73 | ITK (0.50) | IMPDH2IMPDH1ITKDRD2DRD4 |
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-106478500-A | Carboxylic acid-substituted（Miscellaneous）Aromatic ring analog derivative and its production and use | 广东东阳光药业有限公司 | 2017-03-08 | — | — | CN | disclosed |