Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | PI4KA | P42356 | 1/20 | 0.31 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.31 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.31 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PRKACA | P17612 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2000322 | 0.76 | PI4KA (0.53) | PI4KAPI4K2BPI4K2API4KBMAP4K4 | |
| SCHEMBL5391951 | 0.73 | MAPT (0.33) | HTT | |
| SCHEMBL10674984 | 0.72 | — | — | |
| SCHEMBL3820125 | 0.72 | CYP1A2 (0.43) | ABCG2HTTDAPK3MAP4K4ABL1 | |
| Quinazolinone SCHEMBL29709960 | 0.70 | PI4KA (0.56) | ABCG2GAAGLAHTTPI4KA | |
| Quinazolinone SCHEMBL164234 | 0.70 | PI4KA (0.56) | ABCG2GAAGLAHTTPI4KA | |
| Quinazolinone SCHEMBL4629529 | 0.68 | ADORA2A (0.55) | ABCG2GAAGLAHTTPI4KA | |
| SCHEMBL6161286 | 0.68 | PLAU (0.31) | — | |
| SCHEMBL30317618 | 0.67 | PARP1 (0.47) | ABCG2GAAGLAHTTALK | |
| SCHEMBL1192531 | 0.67 | PARP1 (0.47) | ABCG2GAAGLAHTTALK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101356171-A | N4-phenyl-quinazolin-4-amine derivatives and related compounds as ERBBI type receptor tyrosine kinase inhibitors for the treatment of proliferative diseases | ARRAY BIOPHARMA INC (US) | 2009-01-28 | — | — | CN | disclosed |
| US-7060700-B2 | Amide derivatives useful as inhibitors of the production of cytokines | ASTRAZENECA AB (SE) | 2006-06-13 | — | — | US | disclosed |