Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR5A | P47898 | 10/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 4/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8339628 | 0.81 | SLC9A1 (0.46) | SLC9A1HTR7HTR2B | |
| SCHEMBL8339113 | 0.81 | SLC9A1 (0.42) | HTR5ASLC9A1KDM4EL3MBTL1 | |
| SCHEMBL6082100 | 0.81 | ADORA2A (0.36) | KDM4EL3MBTL1CDC7AURKAPRKD3 | |
| SCHEMBL8339462 | 0.78 | HTR5A (0.44) | HTR5ASLC9A1 | |
| SCHEMBL8346528 | 0.76 | RORC (0.38) | HTR5ASLC9A1KDM4EL3MBTL1AURKA | |
| SCHEMBL8336852 | 0.73 | MEN1 (0.46) | MAPK1 | |
| SCHEMBL8340484 | 0.72 | COMT (0.55) | SLC9A1HTR7HTR2B | |
| SCHEMBL25205591 | 0.68 | PIK3R2 (0.38) | KDM4EL3MBTL1CDC7AURKAPRKD3 | |
| SCHEMBL31095534 | 0.68 | PIK3R2 (0.38) | KDM4EL3MBTL1CDC7AURKAPRKD3 | |
| SCHEMBL8337393 | 0.67 | NCF1 (0.45) | HTR5ASLC9A1L3MBTL1MAPK1 |
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-2004007478-A2 | DERIVATIVES OF 3-GUANIDINOCARBONYL-1-HETEROARYL-PYRROLE, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2004-01-22 | — | — | WO | disclosed |