Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 11/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
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 SCHEMBL8699234 | 0.99 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| SCHEMBL8699407 | 0.84 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| SCHEMBL8699379 | 0.84 | CYP3A4 (0.50) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| SCHEMBL8703741 | 0.83 | ALDH1A1 (0.46) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL8704286 | 0.83 | SLC6A4 (0.47) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL8705096 | 0.83 | CYP3A4 (0.49) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL8698987 | 0.82 | ALDH1A1 (0.48) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| SCHEMBL8704859 | 0.82 | SLC6A4 (0.45) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL8704207 | 0.80 | SLC6A4 (0.43) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR | |
| SCHEMBL8699751 | 0.78 | SLC6A2 (0.48) | SLC6A4SLC6A2SLC6A3ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5736568-A | ANTIALLERGENS; IMMUNOMODULANTS | KNOLL AKTIENGESELLSCHAFT (DE) | 1998-04-07 | — | — | US | disclosed |