Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | PRKCG | P05129 | 6/20 | 0.41 |
| ▸ | PRKCB | P05771 | 6/20 | 0.41 |
| ▸ | PRKCA | P17252 | 6/20 | 0.41 |
| ▸ | GSK3B | P49841 | 6/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.41 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TDP2 | O95551 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.35 |
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 SCHEMBL8127101 | 0.98 | CYP2D6 (0.46) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| Hydrochloric Acid SCHEMBL9263878 | 0.98 | CYP2D6 (0.46) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| SCHEMBL9304627 | 0.93 | CYP2D6 (0.41) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| Hydrochloric Acid SCHEMBL8142868 | 0.92 | CYP2D6 (0.40) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| SCHEMBL9305810 | 0.88 | CYP2D6 (0.49) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| SCHEMBL9303584 | 0.87 | CYP2D6 (0.57) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| Hydrochloric Acid SCHEMBL8135773 | 0.86 | CYP2D6 (0.56) | CYP2D6PRKCGPRKCBPRKCAGSK3B | |
| SCHEMBL9303549 | 0.85 | KDM4E (0.39) | ALDH1A1KDM4ETSHRHSD17B10GAA | |
| SCHEMBL14423907 | 0.85 | CYP2D6 (0.34) | CYP2D6KCNH2ALDH1A1KDM4ETSHR | |
| SCHEMBL9305917 | 0.83 | HRH1 (0.38) | KCNH2ALDH1A1KDM4ETSHRHSD17B10 |
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-5296491-A | Pyrazolo[4,3-c]pyridines and their use as serotonin reuptake inhibitors | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1994-03-22 | — | — | US | claimed |