Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 2/20 | 0.52 |
| ▸ | NR2C2 | P49116 | 4/20 | 0.47 |
| ▸ | TAB1 | Q15750 | 4/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.47 |
| ▸ | RELA | Q04206 | 3/20 | 0.47 |
| ▸ | PLK4 | O00444 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 6/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 4/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | KDR | P35968 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5758741 | 0.90 | L3MBTL1 (0.52) | KDRL3MBTL1FLT1FLT4IKBKB | |
| SCHEMBL5760461 | 0.86 | ROCK1 (0.40) | NR2C2TAB1NFKB1NFKB2RELA | |
| SCHEMBL5758921 | 0.83 | IDH1 (0.50) | IDH1NR2C2TAB1NFKB1NFKB2 | |
| SCHEMBL5759805 | 0.82 | CDK2 (0.41) | KDRL3MBTL1FLT1FLT4SYK | |
| SCHEMBL5757754 | 0.82 | PTK2 (0.47) | KDRL3MBTL1FLT1ROCK1SYK | |
| SCHEMBL5761986 | 0.81 | CDK4 (0.42) | SCN9AKDR | |
| SCHEMBL5759742 | 0.81 | SCN9A (0.42) | SCN9AKDRFLT1FLT4ROCK1 | |
| SCHEMBL5760237 | 0.80 | PTK2 (0.58) | KDRFLT1ROCK1SYK | |
| SCHEMBL2373880 | 0.79 | IDH1 (0.48) | IDH1NR2C2TAB1NFKB1NFKB2 | |
| SCHEMBL5760262 | 0.78 | CYP1A2 (0.45) | PLK4KDR |
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-1242403-B1 | 2,4-DIAMINOPYRIMIDINE COMPOUNDS USFUL AS IMMUNOSUPPRESSANTS | PFIZER PROD INC (US) | 2006-01-04 | — | — | EP | claimed |