Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
| ▸ | FPR1 | P21462 | 1/20 | 0.39 |
| ▸ | FPR2 | P25090 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ME3 | Q16798 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13108437 | 0.87 | HCRTR1 (0.61) | HCRTR1POLBTDP1OPRK1FPR1 | |
| SCHEMBL13099548 | 0.87 | HCRTR1 (0.61) | HCRTR1POLBTDP1OPRK1FPR1 | |
| SCHEMBL13397431 | 0.83 | HCRTR1 (0.49) | HCRTR1POLBTDP1OPRK1ALDH1A1 | |
| SCHEMBL13397600 | 0.83 | HCRTR1 (0.66) | HCRTR1POLBTDP1OPRK1ALDH1A1 | |
| SCHEMBL13108384 | 0.81 | HCRTR1 (0.54) | HCRTR1POLBTDP1OPRK1FPR1 | |
| SCHEMBL13099584 | 0.81 | HCRTR1 (0.54) | HCRTR1POLBTDP1OPRK1FPR1 | |
| SCHEMBL13099597 | 0.81 | HCRTR1 (0.58) | HCRTR1POLBTDP1OPRK1FPR1 | |
| SCHEMBL13108448 | 0.81 | HCRTR1 (0.58) | HCRTR1POLBTDP1OPRK1FPR1 | |
| SCHEMBL13108593 | 0.79 | HCRTR1 (0.52) | HCRTR1POLBOPRK1FPR1FPR2 | |
| SCHEMBL13099551 | 0.79 | HCRTR1 (0.52) | HCRTR1POLBOPRK1FPR1FPR2 |
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-2010037050-A2 | SYNTHESIS OF FUNCTIONALIZED OCTAHYDRO-ISOQUINOLIN-1-ONE-8-CARBOXAMIDES, OCTAHYDRO-ISOQUINOLIN-1-ONE-8-CARBOXYLIC ESTERS AND ANALOGS, AND THERAPEUTIC METHODS | UNIVERSITY OF KANSAS (US) | 2010-04-01 | — | — | WO | disclosed |