Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CKS1B | P61024 | 1/20 | 0.42 |
| ▸ | SKP1 | P63208 | 1/20 | 0.42 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 3/20 | 0.41 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19020818 | 0.89 | HPGDS (0.48) | CKS1BSKP1SKP2HPGDSKCNA3 | |
| SCHEMBL4394130 | 0.82 | HPGDS (0.50) | HPGDSGAA | |
| SCHEMBL5185499 | 0.77 | MEN1 (0.53) | CKS1BSKP1SKP2KCNA3PDE10A | |
| SCHEMBL56856 | 0.73 | EPHX1 (0.53) | KCNA3CTSKBTKGAA | |
| Ammonia Solution, Strong SCHEMBL15021680 | 0.72 | EPHX1 (0.52) | KCNA3CTSKBTKDRD2GAA | |
| Hydrochloric Acid SCHEMBL4158527 | 0.72 | EPHX1 (0.52) | KCNA3CTSKBTKDRD2GAA | |
| Water SCHEMBL27795194 | 0.72 | EPHX1 (0.52) | KCNA3CTSKBTKDRD2GAA | |
| SCHEMBL4715249 | 0.70 | CTSK (0.51) | CKS1BSKP1SKP2KCNA3CTSK | |
| SCHEMBL21789373 | 0.70 | JAK1 (0.47) | CKS1BSKP1SKP2KCNA3CTSK | |
| SCHEMBL28544121 | 0.70 | JAK1 (0.47) | CKS1BSKP1SKP2KCNA3CTSK |
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 |
|---|---|---|---|---|---|---|---|
| EP-2129660-A2 | NICOTINAMIDE DERIVATIVES AS INHIBITORS OF H-PGDS AND THEIR USE FOR TREATING PROSTAGLANDIN D2 MEDIATED DISEASES | Pfizer Products Inc. (US) | 2009-12-09 | — | — | EP | disclosed |
| WO-2008075172-A2 | NICOTINAMIDE DERIVATIVES AS INHIBITORS OF H-PGDS AND THEIR USE FOR TREATING PROSTAGLANDIN D2 MEDIATED DISEASES | PFIZER PRODUCTS INC. (US) | 2008-06-26 | — | — | WO | disclosed |