Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 6/20 | 0.39 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.38 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 2/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 3/20 | 0.36 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.36 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL11963067 | 1.00 | KDM4E (0.40) | KDM4EALDH1A1SMN1; SMN2CCR2SLC6A7 | |
| SCHEMBL12817788 | 0.82 | CCR2 (0.54) | CCR2CHRM1 | |
| SCHEMBL11963537 | 0.82 | PARP1 (0.51) | CCR2ACACBCNR1CNR2 | |
| SCHEMBL11963538 | 0.82 | PARP1 (0.51) | CCR2ACACBCNR1CNR2 | |
| SCHEMBL4823374 | 0.81 | PBRM1 (0.53) | SLC6A7BTKCYP2C8KCNH2PBRM1 | |
| SCHEMBL2226606 | 0.81 | PBRM1 (0.53) | SLC6A7BTKCYP2C8KCNH2PBRM1 | |
| SCHEMBL6625801 | 0.80 | KCNH2 (0.44) | KDM4EALDH1A1MAP3K12BTKCYP2C8 | |
| SCHEMBL11963475 | 0.78 | MAP3K13 (0.39) | CCR2MAP3K12ACACBTYK2JAK1 | |
| SCHEMBL11963527 | 0.78 | PDGFRA (0.41) | CCR2MAP3K12 | |
| SCHEMBL11963327 | 0.77 | SLC6A7 (0.32) | CCR2SLC6A7MAP3K12TYK2JAK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2441755-A1 | Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors | Almirall, S.A. (ES) | 2012-04-18 | — | — | EP | disclosed |