Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | HTR2B | P41595 | 1/20 | 0.58 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.58 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.54 |
| ▸ | MGLL | Q99685 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | CCR6 | P51684 | 1/20 | 0.52 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13163154 | 0.87 | HTT (0.62) | ALDH1A1HTTCYP2C9CYP2C19HTR2B | |
| SCHEMBL23716681 | 0.83 | CCR5 (0.49) | ALDH1A1 | |
| SCHEMBL22772142 | 0.83 | CCR5 (0.49) | ALDH1A1 | |
| SCHEMBL21891703 | 0.83 | CPB1 (0.60) | ALDH1A1KMT2A | |
| SCHEMBL22735368 | 0.82 | CYP46A1 (0.54) | ALDH1A1MGLLPOLBHPGD | |
| SCHEMBL10274564 | 0.81 | ALDH1A1 (0.70) | ALDH1A1HTTCYP2C9CYP2C19HTR2B | |
| SCHEMBL8804588 | 0.80 | HTT (0.47) | ALDH1A1HTTKMT2APOLB | |
| SCHEMBL21177607 | 0.80 | RAB9A (0.43) | ALDH1A1CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL21177577 | 0.80 | RAB9A (0.43) | ALDH1A1CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL10722320 | 0.79 | HTT (0.89) | ALDH1A1HTTCYP2C9CYP2C19HTR2B |
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-2009140467-A1 | OXOBENZINDOLIZINOQUINOLINES AND USES THEREOF | PURDUE RESEARCH FOUNDATION (US) | 2009-11-19 | — | — | WO | disclosed |