Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 7/20 | 0.36 |
| ▸ | SRC | P12931 | 7/20 | 0.36 |
| ▸ | ABL2 | P42684 | 7/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.33 |
| ▸ | MELK | Q14680 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3378590 | 1.00 | CHEK1 (0.39) | CHEK1ABL1SRCABL2TLR9 | |
| SCHEMBL3375050 | 0.86 | TLR9 (0.40) | CHEK1TLR9TLR8TLR7KDM1A | |
| SCHEMBL3379792 | 0.86 | RORC (0.38) | CHEK1ABL1SRCABL2TLR9 | |
| SCHEMBL3379795 | 0.86 | RORC (0.38) | CHEK1ABL1SRCABL2TLR9 | |
| SCHEMBL3375046 | 0.86 | TLR9 (0.40) | CHEK1TLR9TLR8TLR7KDM1A | |
| Hydrochloric Acid SCHEMBL3377052 | 0.85 | TLR9 (0.39) | CHEK1TLR9TLR8TLR7KDM1A | |
| Hydrochloric Acid SCHEMBL3377057 | 0.85 | TLR9 (0.39) | CHEK1TLR9TLR8TLR7KDM1A | |
| SCHEMBL3352394 | 0.84 | KCNH2 (0.41) | ABL1SRCABL2XDHKCNH2 | |
| SCHEMBL3352400 | 0.84 | KCNH2 (0.41) | ABL1SRCABL2XDHKCNH2 | |
| SCHEMBL3378582 | 0.81 | RORC (0.33) | ABL1SRCABL2XDHKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010046388-A1 | SUBSTITUTED (AZA) -1-METHYL-1H-QUINOLIN-2-ONES AS ANTIBACTERIALS | GLAXO GROUP LIMITED (GB) | 2010-04-29 | — | — | WO | disclosed |