Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.36 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9207113 | 0.98 | HTT (0.52) | HTTADRA1BGRM5ACHEBCHE | |
| Hydrochloric Acid SCHEMBL9213957 | 0.97 | HTT (0.51) | HTTADRA1BGRM5ACHEBCHE | |
| Hydrochloric Acid SCHEMBL9742044 | 0.87 | HTT (0.51) | HTTACHEHTR1ADRD3MEN1 | |
| Hydrochloric Acid SCHEMBL9206777 | 0.83 | HTT (0.52) | HTTABCB1 | |
| SCHEMBL9207082 | 0.83 | BCHE (0.48) | GRM5ACHEBCHEDRD4FAAH | |
| SCHEMBL9217306 | 0.83 | ADRA1B (0.46) | HTTADRA1BGRM5DRD4HTR1A | |
| SCHEMBL9209429 | 0.82 | ADRA1B (0.45) | ADRA1BGRM5ACHEDRD4HTR1A | |
| SCHEMBL9208530 | 0.81 | BCHE (0.50) | GRM5ACHEBCHEDRD4FAAH | |
| Hydrochloric Acid SCHEMBL9213818 | 0.81 | HTT (0.55) | HTTABCB1 | |
| SCHEMBL9208286 | 0.80 | ADRA1B (0.41) | HTTADRA1BGRM5ACHEABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0655996-A1 | SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES | PFIZER INC. (US) | 1995-06-07 | — | — | EP | disclosed |