Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | FPR3 | P25089 | 2/20 | 0.38 |
| ▸ | FPR2 | P25090 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | EBP | Q15125 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL4030051 | 0.88 | PAOX (0.46) | PAOXSMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL805269 | 0.81 | CYP1A2 (0.63) | PAOXCYP1A2MAPK1SMN1; SMN2FPR3 | |
| SCHEMBL13135994 | 0.79 | PAOX (0.47) | PAOXCYP1A2MAPK1SMN1; SMN2ACHE | |
| SCHEMBL11523231 | 0.79 | PAOX (0.85) | PAOXCYP1A2MAPK1SMN1; SMN2ACHE | |
| SCHEMBL279742 | 0.79 | CYP1A2 (0.67) | PAOXCYP1A2MAPK1SMN1; SMN2FPR3 | |
| Hydrochloric Acid SCHEMBL15169053 | 0.79 | CYP1A2 (0.61) | PAOXCYP1A2MAPK1SMN1; SMN2FPR3 | |
| Hydrochloric Acid SCHEMBL5205856 | 0.79 | PAOX (0.60) | PAOXCYP1A2MAPK1SMN1; SMN2ACHE | |
| Hydrochloric Acid SCHEMBL11824629 | 0.78 | CYP1A2 (0.64) | PAOXCYP1A2MAPK1SMN1; SMN2FPR3 | |
| SCHEMBL9058297 | 0.77 | CYP1A2 (0.46) | CYP1A2TSHRLMNAALDH1A1 | |
| SCHEMBL24207504 | 0.76 | PAOX (0.61) | PAOXCYP1A2MAPK1SMN1; SMN2ACHE |
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-0784620-B1 | N-SUBSTITUTED PIPERIDINYL BICYCLIC BENZOATE DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 1999-12-08 | — | — | EP | claimed |