Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 10/20 | 0.43 |
| ▸ | HTR1D | P28221 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 2/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4721628 | 0.94 | HTR1B (0.47) | HTR1BHTR1DCNR1CNR2TLR8 | |
| SCHEMBL4724855 | 0.89 | ENPP1 (0.44) | HTR1BHTR1DTLR8MEN1KMT2A | |
| SCHEMBL4724144 | 0.82 | ALDH1A1 (0.41) | CNR2MEN1KMT2ATSHRNPC1 | |
| SCHEMBL4719990 | 0.81 | CNR1 (0.41) | HTR1BHTR1DCNR1CNR2TLR8 | |
| SCHEMBL4723779 | 0.77 | TLR8 (0.40) | TLR8MEN1KMT2ATSHRPDE5A | |
| SCHEMBL4722971 | 0.76 | CNR1 (0.44) | HTR1BHTR1DCNR1CNR2MEN1 | |
| SCHEMBL28075369 | 0.75 | HTR1B (0.54) | HTR1BHTR1DCNR1CNR2SLC6A4 | |
| SCHEMBL4724769 | 0.75 | CNR1 (0.43) | HTR1BHTR1DCNR1CNR2MEN1 | |
| SCHEMBL4723799 | 0.74 | HTR1B (0.43) | HTR1BHTR1DCNR1CNR2TLR8 | |
| SCHEMBL4723379 | 0.74 | ALDH1A1 (0.40) | HTR1BHTR1DCNR1CNR2TLR8 |
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-1957495-A1 | FUSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007064045-A1 | FUSED HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-06-07 | — | — | WO | disclosed |