Sorafenib

Sorafenib

SCHEMBL28204502

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1.Cc1ccc(S(=O)(=O)O)cc1.O

nearest known ligand 0.98

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
KDR known ✓ P35968 6/20 0.98
RAF1 known ✓ P04049 12/20 0.80
BRAF known ✓ P15056 4/20 0.80
RET known ✓ P07949 3/20 0.80
PDGFRB known ✓ P09619 2/20 0.80
KIT known ✓ P10721 2/20 0.80
FLT1 known ✓ P17948 2/20 0.80
FLT4 known ✓ P35916 2/20 0.80
FLT3 known ✓ P36888 2/20 0.80
AURKB Q96GD4 2/20 0.98
NTSR1 P30989 1/20 0.98
MC4R P32245 1/20 0.98
PAX8 Q06710 1/20 0.98
RIPK2 O43353 2/20 0.80
ABCB11 O95342 2/20 0.80
ABL1 P00519 2/20 0.80
HTR1A P08908 2/20 0.80
ADORA3 P0DMS8 2/20 0.80
FGFR1 P11362 2/20 0.80
PDGFRA P16234 2/20 0.80

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 SCHEMBL18496409 0.99 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL29919725 0.99 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL162935 0.99 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL15939735 0.99 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL3660939 0.98 KDR (0.98) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL3664023 0.96 KDR (0.94) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL16051185 0.96 KDR (0.94) KDRAURKBNTSR1MC4RPAX8
Cm-4307 SCHEMBL14673524 0.94 KDR (0.90) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL1702335 0.93 KDR (0.85) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL19322 0.92 KDR (0.87) KDRAURKBNTSR1MC4RPAX8

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108368052-A Sorafenib hemiparatoluenesulfonate monohydrate crystal and preparation method thereof 正大天晴药业集团股份有限公司 2018-08-03 CN claimed
CN-107840823-A For the method for the scalable for preparing Sorafenib Tosylate alcohol solvent compound and III type Sorafenib Tosylates 意大利合成制造有限公司 2018-03-27 CN claimed
CN-117088809-A Sorafenib-malonic acid eutectic crystal and preparation method thereof 浙江工业大学 2023-11-21 CN disclosed
CN-109796400-B Sorafenib tosylate crystal form and preparation method thereof 四川科伦药物研究院有限公司 2022-07-29 CN disclosed
CN-106748996-B Sorafenib tosylate crystal compound and preparation method thereof 山东裕欣药业有限公司 2020-03-20 CN disclosed
CN-108368052-A Sorafenib hemiparatoluenesulfonate monohydrate crystal and preparation method thereof 正大天晴药业集团股份有限公司 2018-08-03 CN disclosed
CN-108368052-A Sorafenib hemiparatoluenesulfonate monohydrate crystal and preparation method thereof 正大天晴药业集团股份有限公司 2018-08-03 CN disclosed
CN-108368052-A Sorafenib hemiparatoluenesulfonate monohydrate crystal and preparation method thereof 正大天晴药业集团股份有限公司 2018-08-03 CN disclosed
CN-107840823-A For the method for the scalable for preparing Sorafenib Tosylate alcohol solvent compound and III type Sorafenib Tosylates 意大利合成制造有限公司 2018-03-27 CN disclosed