Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.49 |
| ▸ | HTR3B | O95264 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.49 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 7/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL5873479 | 0.94 | ALDH1A1 (0.54) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL6559990 | 0.80 | MCHR1 (0.43) | ALDH1A1LMNAMCHR1NPC1POLB | |
| SCHEMBL3386080 | 0.78 | ALDH1A1 (0.58) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL3540666 | 0.78 | ALDH1A1 (0.60) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL4846555 | 0.77 | ALDH1A1 (0.51) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL27480804 | 0.75 | ALDH1A1 (0.57) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL5832121 | 0.74 | ALDH1A1 (0.59) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL4848007 | 0.74 | ALDH1A1 (0.53) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL5873493 | 0.73 | MCHR1 (0.46) | ALDH1A1SLC6A4HTR3AHTR1ALMNA | |
| SCHEMBL5873582 | 0.73 | ALDH1A1 (0.76) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1450801-A2 | 2-AMINOQUINOLINE COMPOUNDS | Merck & Co., Inc. (US) | 2004-09-01 | — | — | EP | disclosed |
| WO-2003045313-A2 | 2-AMINOQUINOLINE COMPOUNDS | MERCK & CO. INC. (US) | 2003-06-05 | — | — | WO | disclosed |