Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL6188780 | 0.85 | CA12 (0.41) | ADORA3KDM4EMAPTALDH1A1HPGD | |
| SCHEMBL11382454 | 0.83 | ALDH1A1 (0.44) | ADORA3KDM4EMAPTALDH1A1NPC1 | |
| SCHEMBL8088888 | 0.83 | ALDH1A1 (0.37) | KDM4EMAPTALDH1A1HPGDNPC1 | |
| SCHEMBL9528089 | 0.78 | CYP2D6 (0.41) | KDM4EMAPTALDH1A1HPGDNPC1 | |
| SCHEMBL9453427 | 0.78 | CYP2D6 (0.46) | KDM4EMAPTALDH1A1HPGDNPC1 | |
| SCHEMBL10700335 | 0.75 | ABL1 (0.44) | ADORA3KDM4EMAPTALDH1A1HPGD | |
| SCHEMBL1867724 | 0.75 | ABL1 (0.50) | MAPTNPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL8089529 | 0.75 | CA12 (0.41) | ALDH1A1NPC1RAB9ASMN1; SMN2CLK4 | |
| SCHEMBL8089555 | 0.74 | NPC1 (0.38) | MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6208639 | 0.74 | L3MBTL1 (0.48) | MAPTALDH1A1RAB9ALMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2049502-B1 | 2,4-SUBSTITUTED QUINAZOLINES AS LIPID KINASE INHIBITORS | NOVARTIS AG (CH) | 2012-01-04 | — | — | EP | claimed |