Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7328880 | 0.73 | HTR4 (0.50) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| SCHEMBL7327093 | 0.72 | KCNH2 (0.45) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| Hydrochloric Acid SCHEMBL7324155 | 0.72 | KCNH2 (0.44) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| SCHEMBL8321572 | 0.70 | HTR4 (0.56) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| SCHEMBL7383392 | 0.70 | KCNH2 (0.51) | KCNH2DRD4HTR7 | |
| Hydrochloric Acid SCHEMBL7498481 | 0.69 | HTR4 (0.55) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| SCHEMBL7346874 | 0.68 | KCNH2 (0.46) | HTR4KCNH2 | |
| Hydrochloric Acid SCHEMBL7417007 | 0.68 | HTR4 (0.46) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| SCHEMBL7411902 | 0.68 | HTR4 (0.46) | HTR4KCNH2CHRM1CHRM2CHRM4 | |
| SCHEMBL7328890 | 0.68 | OPRD1 (0.32) | — |
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-0664806-A1 | HETEROCYCLIC CONDENSED BENZOIC ACID DERIVATIVES AS 5-HT 4? RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-08-02 | — | — | EP | claimed |
| WO-1994008995-A1 | HETEROCYCLIC CONDENSED BENZOIC ACID DERIVATIVES AS 5-HT4 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-04-28 | — | — | WO | claimed |