Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | HPGDS | O60760 | 2/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL18756225 | 0.91 | KMT2A (0.52) | KMT2APDE3BPDE3ACNR2HPGDS | |
| SCHEMBL18756217 | 0.85 | GABRA1 (0.46) | CNR2CHRM4CHRM1 | |
| SCHEMBL18756230 | 0.85 | CHRM1 (0.46) | KMT2ACHRM1 | |
| SCHEMBL18725426 | 0.85 | CHRM1 (0.46) | KMT2ACHRM1 | |
| SCHEMBL22212651 | 0.81 | KMT2A (0.46) | KMT2APDE3BPDE3ACNR2HPGDS | |
| SCHEMBL19932716 | 0.81 | KMT2A (0.46) | KMT2APDE3BPDE3ACNR2HPGDS | |
| SCHEMBL17440045 | 0.80 | CHRM1 (0.50) | CNR1CHRM1 | |
| SCHEMBL18756165 | 0.76 | ADORA2A (0.45) | CNR2HPGDSABHD6CNR1CHRM1 | |
| SCHEMBL18725510 | 0.75 | CHRM1 (0.47) | KMT2ACHRM1 | |
| SCHEMBL22212650 | 0.74 | NPC1 (0.49) | KMT2ACNR2HPGDSNPC1RAB9A |
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-3156397-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2017-04-19 | — | — | EP | disclosed |