Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 5/20 | 0.61 |
| ▸ | DRD2 | P14416 | 4/20 | 0.61 |
| ▸ | HTR6 | P50406 | 4/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.61 |
| ▸ | HTR1A | P08908 | 3/20 | 0.61 |
| ▸ | HTR2A | P28223 | 3/20 | 0.61 |
| ▸ | HTR7 | P34969 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | DRD1 | P21728 | 1/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.61 |
| ▸ | DRD3 | P35462 | 1/20 | 0.61 |
| ▸ | HEXA | P06865 | 1/20 | 0.44 |
| ▸ | HEXB | P07686 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 5/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
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 SCHEMBL11743623 | 0.99 | HRH1 (0.60) | HRH1DRD2HTR6SLC6A4HTR1A | |
| SCHEMBL11745499 | 0.93 | DRD2 (0.52) | HRH1DRD2HTR6SLC6A4HTR1A | |
| Hydrochloric Acid SCHEMBL11747188 | 0.91 | DRD2 (0.51) | HRH1DRD2HTR6SLC6A4HTR1A | |
| SCHEMBL11747930 | 0.90 | DRD2 (0.69) | HRH1DRD2HTR6SLC6A4HTR1A | |
| SCHEMBL11751843 | 0.88 | CHRM2 (0.46) | HRH1DRD2HTR6SLC6A4HTR1A | |
| SCHEMBL11747017 | 0.86 | DRD2 (0.45) | HRH1DRD2HTR6SLC6A4HTR1A | |
| Hydrochloric Acid SCHEMBL11744637 | 0.86 | CHRM2 (0.45) | HRH1DRD2HTR6SLC6A4HTR1A | |
| Hydrochloric Acid SCHEMBL11746929 | 0.85 | DRD2 (0.44) | HRH1DRD2HTR6SLC6A4HTR1A | |
| SCHEMBL8790016 | 0.85 | BRD4 (0.47) | HRH1DRD2HTR6SLC6A4HTR1A | |
| SCHEMBL8791355 | 0.84 | ALDH1A1 (0.48) | HRH1DRD2HTR6SLC6A4HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| US-4021557-A | BRONCHOSPASMOLYTICS | BOEHRINGER INGELHEIM GMBH (DT) | 1977-05-03 | — | — | US | claimed |
| US-4021557-A | BRONCHOSPASMOLYTICS | BOEHRINGER INGELHEIM GMBH (DT) | 1977-05-03 | — | — | US | disclosed |