Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.74 |
| ▸ | HPGD | P15428 | 4/20 | 0.67 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2330242 | 0.90 | GAA (0.82) | GAAKDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL6127192 | 0.85 | KDM4E (0.89) | GAAKDM4ESMN1; SMN2NPC1CYP1A2 | |
| SCHEMBL4045277 | 0.84 | KDM4E (0.81) | GAAKDM4ESMN1; SMN2NPC1CYP1A2 | |
| SCHEMBL5246151 | 0.83 | KDM4E (0.78) | GAAKDM4ESMN1; SMN2NPC1CYP1A2 | |
| SCHEMBL12491925 | 0.83 | GAA (0.70) | GAAKDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL18197872 | 0.83 | KDM4E (0.84) | GAAKDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL18906066 | 0.82 | KDM4E (0.83) | GAAKDM4ESMN1; SMN2NPC1CYP1A2 | |
| SCHEMBL3814103 | 0.82 | GAA (0.69) | GAAKDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL8966500 | 0.81 | GAA (0.68) | GAAKDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL6928579 | 0.81 | KDM4E (0.76) | GAAKDM4ESMN1; SMN2NPC1CYP1A2 |
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-2509602-A1 | PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS | Cylene Pharmaceuticals, Inc. (US) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011068667-A1 | PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS | CYLENE PHARMACEUTICALS, INC. (US) | 2011-06-09 | — | — | WO | disclosed |