Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | MLNR | O43193 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | NPY1R | P25929 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8211139 | 0.80 | AQP1 (0.46) | AQP1TRPA1DRD2HTR2AHTR2C | |
| SCHEMBL4927574 | 0.78 | AQP1 (0.37) | AQP1TRPA1DRD2HTR2AHTR2C | |
| SCHEMBL4226266 | 0.72 | AQP1 (0.59) | AQP1TRPA1HTR2AHTR2CHTR2B | |
| Ammonia Solution, Strong SCHEMBL27703102 | 0.72 | PARP1 (0.44) | AQP1HTR1AHTR2AHTR2CAKR1C3 | |
| SCHEMBL8254383 | 0.71 | CTNNB1 (0.39) | TRPA1HTR1ASLC6A4KCNH2AKR1C3 | |
| SCHEMBL8211141 | 0.68 | AQP1 (0.43) | AQP1HTR2CHTR2BNFKB1NFKB2 | |
| SCHEMBL8215359 | 0.68 | AQP1 (0.48) | AQP1 | |
| SCHEMBL8216108 | 0.67 | AQP1 (0.40) | AQP1TRPA1HTR2CHTR2BNFKB1 | |
| SCHEMBL4595505 | 0.67 | AR (0.34) | TRPA1AKR1C3AKR1C2 | |
| SCHEMBL6367863 | 0.67 | HTT (0.36) | AKR1C3AKR1C2 |
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-2007123941-A2 | CHROMANE AND CHROMENE DERIVATIVES AND USES THEREOF | WYETH (US) | 2007-11-01 | — | — | WO | disclosed |