Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.44 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.42 |
| ▸ | LAP3 | P28838 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.41 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3365888 | 0.86 | S1PR2 (0.46) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL20630673 | 0.86 | S1PR2 (0.44) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| Hydrochloric Acid SCHEMBL31461596 | 0.84 | ALDH1A1 (0.41) | ALDH1A1TP53GRIK1GRIK2SLC1A2 | |
| SCHEMBL9845854 | 0.82 | TSHR (0.54) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL28860544 | 0.81 | ALDH1A1 (0.59) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL27617597 | 0.81 | MAPT (0.46) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL1736123 | 0.80 | S1PR2 (0.45) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL20629845 | 0.80 | CYP3A4 (0.47) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL15954723 | 0.80 | S1PR2 (0.45) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL27879714 | 0.80 | S1PR2 (0.45) | ALDH1A1S1PR2S1PR1S1PR3S1PR4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0984942-B1 | LIQUID BENZ-ISO-QUINOLINE DERIVATIVES | UNITED COLOR MFG INC (US) | 2003-09-10 | — | — | EP | disclosed |
| EP-0984942-A1 | LIQUID BENZ-ISO-QUINOLINE DERIVATIVES | United Color Manufacturing Inc. (US) | 2000-03-15 | — | — | EP | disclosed |
| US-5858930-A | Liquid Benz-iso-Quinoline derivatives | UNITED COLOR MANUFACTURING, INC. (US) | 1999-01-12 | — | — | US | disclosed |
| WO-1998054150-A1 | LIQUID BENZ-ISO-QUINOLINE DERIVATIVES | UNITED COLOR MANUFACTURING, INC. (US) | 1998-12-03 | — | — | WO | disclosed |