Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | HRH2 | P25021 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | HTR5A | P47898 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL17896038 | 0.99 | CHRM2 (0.52) | CHRM2HTR1ACHRM5ADRA2ADRD2 | |
| SCHEMBL17896029 | 0.95 | CHRM2 (0.46) | CHRM2HTR1ACHRM5ADRA2ADRD2 | |
| Trifluoroacetic Acid SCHEMBL17895987 | 0.91 | CHRM2 (0.42) | CHRM2HTR1ACHRM5ADRA2ADRD2 | |
| SCHEMBL17895999 | 0.89 | HDAC1 (0.43) | CHRM2HTR1ACHRM5ADRA2ADRD2 | |
| Hydrochloric Acid SCHEMBL17895993 | 0.88 | HDAC1 (0.43) | CHRM2HTR1ACHRM5ADRA2ADRD2 | |
| SCHEMBL17895948 | 0.87 | KDM4E (0.45) | KDM4EALDH1A1 | |
| SCHEMBL17896016 | 0.86 | KDM4E (0.41) | HDAC1HDAC6BRD4KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL17896015 | 0.86 | KDM4E (0.40) | HDAC1HDAC6BRD4KDM4EALDH1A1 | |
| SCHEMBL17895862 | 0.84 | KMT2A (0.40) | HTR2AHTR2CKDM4EALDH1A1CREBBP | |
| SCHEMBL17895988 | 0.80 | CHRM2 (0.40) | CHRM2HTR1ACHRM5ADRA2ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016109706-A1 | FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS | PTC THERAPEUTICS, INC. (US) | 2016-07-07 | — | — | WO | claimed |
| WO-2016109706-A1 | FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS | PTC THERAPEUTICS, INC. (US) | 2016-07-07 | — | — | WO | disclosed |