Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 3/20 | 0.45 |
| ▸ | PRKCQ | Q04759 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | ACP1 | P24666 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL1265128 | 0.90 | CYP1A2 (0.43) | VNN1PRKCQGAAHTTKMT2A | |
| SCHEMBL12751067 | 0.78 | MAPT (0.38) | PRKCQGAAHTTKMT2AMAPT | |
| SCHEMBL2550865 | 0.78 | MERTK (0.38) | HTTKMT2AMAPTMEN1RAB9A | |
| SCHEMBL21382480 | 0.78 | MAPT (0.54) | VNN1NPC1GAAHTTKMT2A | |
| SCHEMBL1917614 | 0.74 | MERTK (0.47) | KMT2AMAPTMEN1MAPK9GSK3B | |
| SCHEMBL1916765 | 0.73 | PRKCQ (0.51) | PRKCQHTTKMT2AMAPTMEN1 | |
| SCHEMBL1918193 | 0.72 | SYK (0.51) | DYRK1AGSK3B | |
| SCHEMBL14061778 | 0.72 | MEN1 (0.41) | NPC1KMT2AMAPTMEN1DYRK1A | |
| SCHEMBL1474749 | 0.71 | PRKCQ (0.43) | PRKCQGAAHTTKMT2AMAPT | |
| SCHEMBL1396933 | 0.70 | NPC1 (0.50) | PRKCQNPC1GAAHTTKMT2A |
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-101955464-A | 4-(4-methoxybenzylamino)-3-(5-nitro-4-thiocyanic acid pyrimidine-2-amino) benzonitrile, preparation method and application thereof | TOPHARMAN SHANGHAI CO LTD | 2011-01-26 | — | — | CN | claimed |
| CN-101955464-A | 4-(4-methoxybenzylamino)-3-(5-nitro-4-thiocyanic acid pyrimidine-2-amino) benzonitrile, preparation method and application thereof | TOPHARMAN SHANGHAI CO LTD | 2011-01-26 | — | — | CN | disclosed |