Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.55 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 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 | |
|---|---|---|---|---|
| SCHEMBL20031104 | 0.83 | LDHA (0.47) | HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL15357058 | 0.83 | HRH3 (0.50) | HRH3CRBNHCRTR1HCRTR2MAOA | |
| SCHEMBL2554680 | 0.81 | HRH3 (0.58) | HRH3CRBNHCRTR1HCRTR2MAOA | |
| SCHEMBL2550688 | 0.81 | CRBN (0.50) | HRH3CRBNHCRTR1HCRTR2MAOA | |
| SCHEMBL2549387 | 0.80 | HRH3 (0.57) | HRH3CRBNMAOAACHEMEN1 | |
| SCHEMBL13161917 | 0.80 | HRH3 (0.55) | HRH3CRBNHCRTR1HCRTR2MAOA | |
| SCHEMBL13163985 | 0.79 | HRH3 (0.49) | HRH3CRBNHCRTR1HCRTR2MAOA | |
| SCHEMBL13161921 | 0.79 | HRH3 (0.60) | HRH3CRBNHCRTR1HCRTR2MEN1 | |
| SCHEMBL13162809 | 0.77 | HRH3 (0.64) | HRH3CRBNHCRTR1HCRTR2MEN1 | |
| SCHEMBL2555446 | 0.76 | HRH3 (0.54) | HRH3CRBNHCRTR1HCRTR2MAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018059314-A1 | AZABICYCLE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2018-04-05 | — | — | WO | disclosed |