Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 13/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 12/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9695586 | 0.88 | KCNH2 (0.51) | HRH1CYP2D6KCNH2CHRM1RAB9A | |
| Hydrochloric Acid SCHEMBL9543210 | 0.86 | HRH1 (0.55) | HRH1CYP2D6KCNH2CHRM1RAB9A | |
| SCHEMBL9695626 | 0.86 | KCNH2 (0.61) | HRH1CYP2D6KCNH2CHRM1RAB9A | |
| SCHEMBL9696761 | 0.85 | CYP2D6 (0.43) | HRH1CYP2D6KCNH2CHRM1RAB9A | |
| SCHEMBL15569367 | 0.85 | KCNH2 (0.51) | HRH1CYP2D6KCNH2RAB9AALOX5AP | |
| SCHEMBL9445676 | 0.84 | HRH1 (0.68) | HRH1CYP2D6KCNH2CHRM1TP53 | |
| SCHEMBL9697130 | 0.82 | KCNH2 (0.48) | HRH1CYP2D6KCNH2CHRM1ALOX5AP | |
| SCHEMBL9696461 | 0.81 | GAA (0.49) | HRH1CYP2D6KCNH2CHRM1TP53 | |
| SCHEMBL9445684 | 0.81 | HRH1 (0.49) | HRH1CYP2D6KCNH2CHRM1RAB9A | |
| SCHEMBL9697133 | 0.80 | ALDH1A1 (0.48) | TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5380731-A | Antiallergic compounds | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-01-10 | — | — | US | disclosed |
| EP-0561973-A1 | ANTIALLERGIC COMPOUNDS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-09-29 | — | — | EP | disclosed |
| WO-1992010491-A1 | ANTIALLERGIC COMPOUNDS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-06-25 | — | — | WO | disclosed |
| WO-1992006086-A1 | NOVEL 4-PIPERIDINYLCARBONYL DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-04-16 | — | — | WO | disclosed |