Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 2/20 | 0.42 |
| ▸ | CKS1B | P61024 | 1/20 | 0.41 |
| ▸ | SKP1 | P63208 | 1/20 | 0.41 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13734237 | 0.87 | BTK (0.46) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL13737164 | 0.87 | BTK (0.46) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL5527336 | 0.87 | BTK (0.46) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL26135662 | 0.81 | BTK (0.51) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL22860392 | 0.81 | NFKB1 (0.39) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL470791 | 0.79 | BTK (0.53) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL1498382 | 0.79 | BTK (0.53) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL117269 | 0.78 | BTK (0.51) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL10343938 | 0.77 | BTK (0.61) | KDM1AMAOBBTKDRD2NFKB1 | |
| SCHEMBL3702152 | 0.77 | BTK (0.61) | KDM1AMAOBBTKDRD2NFKB1 |
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-3448386-B1 | ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF | SAMUMED LLC (US) | 2021-03-03 | — | — | EP | disclosed |