Reaction Details Report a problem with these data
Target
Friend leukemia integration 1 transcription factor/RNA-binding protein EWS
Ligand
BDBM50497658
Substrate
n/a
Meas. Tech.
ChEMBL_1440214 (CHEMBL3383759)
IC50
770±n/a nM
Citation
 Tosso, PN; Kong, Y; Scher, L; Cummins, R; Schneider, J; Rahim, S; Holman, KT; Toretsky, J; Wang, K; Üren, A; Brown, ML Synthesis and structure-activity relationship studies of small molecule disruptors of EWS-FLI1 interactions in Ewing's sarcoma. J Med Chem 57:10290-303 (2014) [PubMed]  Article 
Target
Name:
Friend leukemia integration 1 transcription factor/RNA-binding protein EWS
Synonyms:
Friend leukemia integration 1 transcription factor (Proto-oncogene Fli-1)/RNA-binding protein EWS
Type:
n/a
Mol. Mass.:
n/a
Description:
ASSAY_ID of ChEMBL is 1440214
Components:
This complex has 2 components.
Component 1
Name:
RNA-binding protein EWS
Synonyms:
EWS | EWS oncogene | EWSR1 | EWS_HUMAN | Ewing sarcoma breakpoint region 1 protein | RNA-binding protein EWS
Type:
PROTEIN
Mol. Mass.:
68495.63
Organism:
Homo sapiens
Description:
ChEMBL_117112
Residue:
656
Sequence:
MASTDYSTYSQAAAQQGYSAYTAQPTQGYAQTTQAYGQQSYGTYGQPTDVSYTQAQTTATYGQTAYATSYGQPPTGYTTPTAPQAYSQPVQGYGTGAYDTTTATVTTTQASYAAQSAYGTQPAYPAYGQQPAATAPTRPQDGNKPTETSQPQSSTGGYNQPSLGYGQSNYSYPQVPGSYPMQPVTAPPSYPPTSYSSTQPTSYDQSSYSQQNTYGQPSSYGQQSSYGQQSSYGQQPPTSYPPQTGSYSQAPSQYSQQSSSYGQQSSFRQDHPSSMGVYGQESGGFSGPGENRSMSGPDNRGRGRGGFDRGGMSRGGRGGGRGGMGSAGERGGFNKPGGPMDEGPDLDLGPPVDPDEDSDNSAIYVQGLNDSVTLDDLADFFKQCGVVKMNKRTGQPMIHIYLDKETGKPKGDATVSYEDPPTAKAAVEWFDGKDFQGSKLKVSLARKKPPMNSMRGGLPPREGRGMPPPLRGGPGGPGGPGGPMGRMGGRGGDRGGFPPRGPRGSRGNPSGGGNVQHRAGDWQCPNPGCGNQNFAWRTECNQCKAPKPEGFLPPPFPPPGGDRGRGGPGGMRGGRGGLMDRGGPGGMFRGGRGGDRGGFRGGRGMDRGGFGGGRRGGPGGPPGPLMEQMGGRRGGRGGPGKMDKGEHRQERRDRPY
  
Component 2
Name:
Friend leukemia integration 1 transcription factor
Synonyms:
FLI1 | FLI1_HUMAN | Friend leukemia integration 1 transcription factor | Proto-oncogene Fli-1 | Transcription factor ERGB
Type:
PROTEIN
Mol. Mass.:
50985.79
Organism:
Homo sapiens (Human)
Description:
ChEMBL_117112
Residue:
452
Sequence:
MDGTIKEALSVVSDDQSLFDSAYGAAAHLPKADMTASGSPDYGQPHKINPLPPQQEWINQPVRVNVKREYDHMNGSRESPVDCSVSKCSKLVGGGESNPMNYNSYMDEKNGPPPPNMTTNERRVIVPADPTLWTQEHVRQWLEWAIKEYSLMEIDTSFFQNMDGKELCKMNKEDFLRATTLYNTEVLLSHLSYLRESSLLAYNTTSHTDQSSRLSVKEDPSYDSVRRGAWGNNMNSGLNKSPPLGGAQTISKNTEQRPQPDPYQILGPTSSRLANPGSGQIQLWQFLLELLSDSANASCITWEGTNGEFKMTDPDEVARRWGERKSKPNMNYDKLSRALRYYYDKNIMTKVHGKRYAYKFDFHGIAQALQPHPTESSMYKYPSDISYMPSYHAHQQKVNFVPPHPSSMPVTSSSFFGAASQYWTSPTGGIYPNPNVPRHPNTHVPSHLGSYY
  
Inhibitor
Name:
BDBM50497658
Synonyms:
CHEMBL3360384
Type:
Small organic molecule
Emp. Form.:
C19H19NO6
Mol. Mass.:
357.3573
SMILES:
COc1ccc(cc1)C(=O)CC1(O)C(=O)Nc2c1c(OC)ccc2OC
Structure:
Search PDB for entries with ligand similarity: