Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 5/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.45 |
| ▸ | BCHE | P06276 | 3/20 | 0.44 |
| ▸ | ACHE | P22303 | 3/20 | 0.44 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.44 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | PREP | P48147 | 2/20 | 0.42 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.42 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24447908 | 0.79 | CTSL (0.50) | CASP1PSMB1PSMB5PSMB2ALDH1A1 | |
| SCHEMBL8138447 | 0.79 | CTSL (0.50) | CASP1PSMB1PSMB5PSMB2ALDH1A1 | |
| SCHEMBL7298029 | 0.77 | CTRB1 (0.54) | PSMB1PSMB5PSMB2 | |
| SCHEMBL13173061 | 0.77 | CTRB1 (0.54) | PSMB1PSMB5PSMB2 | |
| SCHEMBL8239267 | 0.77 | CTRB1 (0.54) | PSMB1PSMB5PSMB2 | |
| SCHEMBL3330029 | 0.77 | CTSB (0.52) | PSMB1PSMB5PSMB2ALDH1A1CYP1A2 | |
| SCHEMBL7271134 | 0.76 | CTSL (0.56) | CASP1ALDH1A1CYP1A2 | |
| SCHEMBL7271139 | 0.76 | CTSL (0.56) | CASP1ALDH1A1CYP1A2 | |
| SCHEMBL4425695 | 0.76 | CASP1 (0.55) | CASP1PSMB1PSMB5PSMB2 | |
| SCHEMBL1690791 | 0.76 | CASP1 (0.55) | CASP1PSMB1PSMB5PSMB2 |
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-6002009-A | Di-substituted 1,4-piperidine esters and amides having 5-HT4 antagonistic activity | BOEHRINGER INGELHEIM ITALIA, S.P.A. (IT) | 1999-12-14 | — | — | US | disclosed |