Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.39 |
| ▸ | GRM5 | P41594 | 4/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | JAK1 | P23458 | 2/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10269158 | 0.78 | KARS1 (0.46) | KDM4EALDH1A1HPGDADORA2AJAK2 | |
| SCHEMBL902723 | 0.75 | POLB (0.44) | KDM4EALDH1A1JAK2JAK1CCNA2 | |
| SCHEMBL901297 | 0.74 | KMT2A (0.44) | KDM4EJAK2JAK1TYK2KARS1 | |
| SCHEMBL5787755 | 0.72 | KDR (0.47) | KDM4EALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL16503809 | 0.72 | ALDH1A1 (0.64) | KDM4EALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL901328 | 0.71 | RAB9A (0.43) | KDM4EALDH1A1JAK2JAK1TYK2 | |
| SCHEMBL4920343 | 0.71 | CYP2C19 (0.60) | KDM4EALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL1366548 | 0.70 | JAK2 (0.66) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL1366547 | 0.70 | JAK2 (0.66) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL901915 | 0.70 | GRM5 (0.46) | GRM5KMT2A |
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-2441755-A1 | Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors | Almirall, S.A. (ES) | 2012-04-18 | — | — | EP | disclosed |
| WO-2012041476-A1 | PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS | ALMIRALL, S.A. (ES) | 2012-04-05 | — | — | WO | disclosed |