Sorafenib

Sorafenib

SCHEMBL1701746

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1.Cl.O.O.O

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

BRAFFLT1FLT3FLT4KDRKITPDGFRBRAF1RET

The experimentally established mechanism targets of Sorafenib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 known ✓ P04049 12/20 0.96
KDR known ✓ P35968 6/20 0.96
BRAF known ✓ P15056 4/20 0.96
RET known ✓ P07949 3/20 0.96
PDGFRB known ✓ P09619 2/20 0.96
KIT known ✓ P10721 2/20 0.96
FLT1 known ✓ P17948 2/20 0.96
FLT4 known ✓ P35916 2/20 0.96
FLT3 known ✓ P36888 2/20 0.96
EPHX2 P34913 3/20 0.96
RIPK2 O43353 2/20 0.96
ABCB11 O95342 2/20 0.96
ABL1 P00519 2/20 0.96
HTR1A P08908 2/20 0.96
ADORA3 P0DMS8 2/20 0.96
FGFR1 P11362 2/20 0.96
PDGFRA P16234 2/20 0.96
MAOA P21397 2/20 0.96
EPHA1 P21709 2/20 0.96
TBXA2R P21731 2/20 0.96

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.

Compoundsimilaritytop predictedshared targets
Sorafenib SCHEMBL1702117 1.00 RAF1 (0.96) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL1533976 0.99 RAF1 (0.98) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL28894639 0.99 RAF1 (0.98) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL18863920 0.99 RAF1 (0.98) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL16539296 0.98 RAF1 (0.96) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL16539295 0.98 RAF1 (0.96) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL8218 0.98 RAF1 (1.00) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL14739751 0.98 RAF1 (1.00) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL29349634 0.98 RAF1 (1.00) RAF1KDRBRAFRETEPHX2
Sorafenib SCHEMBL1896610 0.97 RAF1 (0.98) RAF1KDRBRAFRETEPHX2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440531-A2 POLYMORPHS OF 4-[4-[[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYLAMINO]PHENOXY]-N-METHYL-PYRIDINE-2-CARBOXAMIDE Ratiopharm GmbH (DE) 2012-04-18 EP disclosed
WO-2010142678-A2 POLYMORPHS OF 4-[4-[[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYLAMINO]PHENOXY]-N-METHYL-PYRIDINE-2-CARBOXAMIDE RATIOPHARM GMBH (DE) 2010-12-16 WO disclosed