Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30398570 | 0.85 | HRH3 (0.55) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL487617 | 0.85 | HRH3 (0.55) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL662973 | 0.83 | HRH3 (0.50) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL2619346 | 0.83 | HRH3 (0.59) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL11860121 | 0.80 | HRH3 (0.56) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL3840575 | 0.80 | HRH3 (0.56) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL2619348 | 0.80 | HRH3 (0.56) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL22404255 | 0.80 | HRH3 (0.56) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL504022 | 0.80 | HRH3 (0.56) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 | |
| SCHEMBL10090177 | 0.80 | HRH3 (0.56) | HRH3CYP1A2CYP2D6KDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-87100928-A | Piperidine derivatives and pharmaceutical compositions thereof | — | 1987-09-09 | — | — | CN | disclosed |