Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 10/20 | 0.76 |
| ▸ | KDR | P35968 | 10/20 | 0.76 |
| ▸ | RAF1 | P04049 | 5/20 | 0.76 |
| ▸ | RET | P07949 | 3/20 | 0.76 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.76 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.76 |
| ▸ | ABL1 | P00519 | 2/20 | 0.76 |
| ▸ | HTR1A | P08908 | 2/20 | 0.76 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.76 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.76 |
| ▸ | KIT | P10721 | 2/20 | 0.76 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.76 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.76 |
| ▸ | FLT1 | P17948 | 2/20 | 0.76 |
| ▸ | MAOA | P21397 | 2/20 | 0.76 |
| ▸ | EPHA1 | P21709 | 2/20 | 0.76 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.76 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.76 |
| ▸ | TTK | P33981 | 2/20 | 0.76 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.76 |
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 | |
|---|---|---|---|---|
| SCHEMBL2922660 | 0.91 | RAF1 (0.73) | BRAFKDRRAF1RETRIPK2 | |
| SCHEMBL5493056 | 0.90 | BRAF (0.70) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL29351376 | 0.86 | RAF1 (1.00) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL432230 | 0.86 | RAF1 (1.00) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL29349808 | 0.86 | RAF1 (1.00) | BRAFKDRRAF1RETRIPK2 | |
| SCHEMBL14751390 | 0.86 | KDR (0.77) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL2555101 | 0.85 | RAF1 (0.98) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL29555444 | 0.85 | RAF1 (0.98) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL29496390 | 0.85 | RAF1 (0.98) | BRAFKDRRAF1RETRIPK2 | |
| Regorafenib SCHEMBL2554008 | 0.85 | RAF1 (0.98) | BRAFKDRRAF1RETRIPK2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1793824-B1 | NEW PHARMACEUTICAL COMPOSITIONS COMPRISING 4-(4-(3-(4-CHLORO-3-TRIFLUOROMETHYL-PHENYL)-UREIDO)-3-FLUORO-PHENOXY)-PYRIDINE-2-CARBOXYLIC ACID FOR THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS | BAYER HEALTHCARE LLC (US) | 2015-11-18 | — | — | EP | claimed |
| EP-2129376-B1 | Treatment of cancers with acquired resistance to KIT inhibitors | BAYER HEALTHCARE LLC (US) | 2013-07-24 | — | — | EP | claimed |
| EP-2097381-B1 | 4-[4-({[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)]CARBAMOYL}AMINO)-3-FLUOROPHENOXY]-N-METHYLPYRIDINE-2-CARBOXAMIDE MONOHYDRATE | BAYER HEALTHCARE LLC (US) | 2013-06-19 | — | — | EP | claimed |
| EP-1663978-B1 | FLUORO SUBSTITUTED OMEGA-CARBOXYARYL DIPHENYL UREA FOR THE TREATMENT AND PREVENTION OF DISEASES AND CONDITIONS | BAYER PHARMACEUTICALS CORP (US) | 2007-11-28 | — | — | EP | claimed |
| EP-2089363-A1 | POLYMORPH II OF 4-[4-({[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}AMINO)-3-FLUOROPHENOXY]N-METHYLPYRIDINE-2-CARBOXAMIDE | Bayer Schering Pharma Aktiengesellschaft (DE) | 2009-08-19 | — | — | EP | disclosed |
| EP-2081902-A1 | POLYMORPH III OF 4-[4-({[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}AMINO)-3-FLUOROPHENOXY]-N-METHYLPYRIDINE-2-CARBOXAMIDE | Bayer Schering Pharma Aktiengesellschaft (DE) | 2009-07-29 | — | — | EP | disclosed |