Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.51 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GLS | O94925 | 2/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7972399 | 0.95 | CYP3A4 (0.48) | CYP4F2CYP4A11CYP3A4CYP2C19GLS | |
| SCHEMBL30844047 | 0.89 | CYP3A4 (0.50) | CYP4F2CYP4A11CYP3A4CYP2C19GLS | |
| SCHEMBL13623152 | 0.89 | CYP3A4 (0.50) | CYP4F2CYP4A11CYP3A4CYP2C19GLS | |
| SCHEMBL27399236 | 0.87 | TLR7 (0.54) | CYP3A4CYP2C19GLSAURKARPS6KB1 | |
| SCHEMBL21219242 | 0.86 | AURKA (0.48) | CYP3A4CYP2C19GLSAURKARPS6KB1 | |
| SCHEMBL6688157 | 0.85 | RAB9A (0.46) | CYP3A4CYP2C19GLSAURKARPS6KB1 | |
| SCHEMBL7378493 | 0.85 | NPC1 (0.48) | CYP3A4CYP2C19GLSAURKARPS6KB1 | |
| SCHEMBL2065025 | 0.84 | CYP3A4 (0.44) | CYP4F2CYP4A11CYP3A4CYP2C19GLS | |
| SCHEMBL13801959 | 0.84 | CYP3A4 (0.50) | CYP3A4CYP2C19GLSAURKARPS6KB1 | |
| SCHEMBL7156537 | 0.84 | MGLL (0.52) | CYP3A4CYP2C19GLSAURKARPS6KB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004106291-A1 | HALOETHYL UREA COMPOUNDS AND THE USE THEREOF TO ATTENUATE, INHIBIT OR PREVENT CANCER CELL MIGRATION | IMOTEP INC. (CA) | 2004-12-09 | — | — | WO | disclosed |
| WO-2004106292-A1 | HALOETHYL UREA COMPOUNDS AND THEIR USE TO ATTENUATE, INHIBIT OR PREVENT NON-CANCEROUS PATHOGENIC CELLULAR PROLIFERATION AND DISEASES ASSOCIATED THEREWITH | IMOTEP INC. (CA) | 2004-12-09 | — | — | WO | disclosed |