Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.37 |
| ▸ | NAMPT | P43490 | 5/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | P2RY1 | P47900 | 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 | |
|---|---|---|---|---|
| SCHEMBL6002974 | 0.82 | CYP11B2 (0.38) | KDM1ANOTUMCYP11B2GPR119NAMPT | |
| SCHEMBL17807330 | 0.81 | NOTUM (0.64) | KDM1ANOTUMCYP11B2P2RY1 | |
| SCHEMBL31568069 | 0.79 | HDAC1 (0.46) | CYP11B2GPR119NAMPT | |
| SCHEMBL30809287 | 0.78 | NOTUM (0.40) | KDM1ANOTUMCYP11B2NR1H2 | |
| SCHEMBL17807353 | 0.75 | NR1H2 (0.36) | KDM1ANOTUMCYP11B2GPR119NR1H2 | |
| SCHEMBL30808966 | 0.75 | UCHL1 (0.39) | KDM1ANOTUMCYP11B2NR1H2 | |
| SCHEMBL994201 | 0.75 | CYP11B1 (0.43) | KDM1ACYP11B2GPR119NAMPTNR1H2 | |
| SCHEMBL17252097 | 0.74 | NR1H2 (0.49) | KDM1ANOTUMCYP11B2NR1H2 | |
| SCHEMBL25169659 | 0.74 | NOTUM (0.44) | KDM1ANOTUMGPR119NR1H2 | |
| SCHEMBL30213385 | 0.74 | NOTUM (0.44) | KDM1ANOTUMGPR119NR1H2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016088903-A1 | HETEROCYCLIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-09 | — | — | WO | disclosed |