Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | LOXL2 | Q9Y4K0 | 9/20 | 0.51 |
| ▸ | LOX | P28300 | 4/20 | 0.46 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL352525 | 0.79 | LOXL2 (0.61) | LOXL2LOXLOXL3 | |
| SCHEMBL25202974 | 0.77 | LOXL2 (0.53) | LOXL2LOXLOXL3PKM | |
| SCHEMBL14910966 | 0.77 | ASIC3 (0.53) | TAAR1KDM4EALDH1A1MAPTBLM | |
| SCHEMBL15941016 | 0.76 | TAAR1 (0.56) | TAAR1KDM4EALDH1A1MAPTBLM | |
| Hydrochloric Acid SCHEMBL25233438 | 0.76 | LOXL2 (0.51) | LOXL2LOXLOXL3PKM | |
| SCHEMBL30485802 | 0.73 | LOXL2 (0.56) | LOXL2LOXLOXL3KDM4EALDH1A1 | |
| SCHEMBL5991845 | 0.73 | LOXL2 (0.70) | TAAR1LOXL2LOXLOXL3ADORA2A | |
| SCHEMBL7036361 | 0.73 | LOXL2 (0.56) | LOXL2LOXLOXL3KDM4EALDH1A1 | |
| SCHEMBL842171 | 0.73 | CCR1 (0.59) | KDM4EALDH1A1MAPTBLMHSD17B10 | |
| SCHEMBL13387726 | 0.72 | ALDH1A1 (0.46) | KDM4EALDH1A1MAPTBLMHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1419545-A | 3-cyanoquinolines, 3-cyano-1,6-naphthyridines, and 3-cyano-1,7-naphthyridines as protein kinase inhibitors | WYETH CORP (US) | 2003-05-21 | — | — | CN | disclosed |
| EP-1268431-A1 | 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS | Wyeth (US) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001072711-A1 | 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS | WYETH (US) | 2001-10-04 | — | — | WO | disclosed |