Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1748539 | 0.80 | SMN1; SMN2 (0.55) | CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1 | |
| SCHEMBL21609744 | 0.74 | SMN1; SMN2 (0.37) | L3MBTL1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL31057923 | 0.74 | SMN1; SMN2 (0.37) | L3MBTL1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL11313513 | 0.73 | LTA4H (0.42) | CYP1A2CYP2C19L3MBTL1GAAMEN1 | |
| SCHEMBL11133778 | 0.73 | MEN1 (0.48) | CYP1A2L3MBTL1KDM4EMAPTMEN1 | |
| SCHEMBL15916364 | 0.72 | LMNA (0.46) | CYP1A2CYP3A4CYP2C19KDM4EGAA | |
| SCHEMBL4588874 | 0.71 | CA1 (0.48) | CYP1A2CYP3A4CYP2C19L3MBTL1KDM4E | |
| SCHEMBL29863822 | 0.71 | CA1 (0.48) | CYP1A2CYP3A4CYP2C19L3MBTL1KDM4E | |
| SCHEMBL16951324 | 0.71 | HPGD (0.48) | CYP1A2CYP2D6CYP2C19L3MBTL1KDM4E | |
| SCHEMBL28569491 | 0.68 | CA1 (0.56) | CYP3A4CYP2D6CYP2C19L3MBTL1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101528702-A | Quinoline compounds and methods of use | ARRAY BIOPHARMA INC (US) | 2009-09-09 | — | — | CN | disclosed |