BDBM100379 US10189794, Compound I-211::US10618902, Compound I-211::US10774052, Compound I-211::US9695132, I-211

SMILES: COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(NC3COCC3NC(=O)C=C)nc2n(C)c1=O

InChI Key: InChIKey=ZIJVLVUPDVUSMA-UHFFFAOYSA-N

Data: 4 IC50

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 100379   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Fibroblast growth factor receptor 4 (Homo sapiens (Human))	BDBM100379 (US10189794, Compound I-211 | US10618902, Compound ...) Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(NC3COCC3NC(=O)C=C)nc2n(C)c1=O |(8.91,2.15,;7.58,1.38,;6.25,2.15,;6.25,3.69,;4.91,4.46,;4.91,6,;6.25,6.77,;3.58,3.69,;2.25,4.46,;3.58,2.15,;4.91,1.38,;4.91,-.16,;2.25,1.38,;.91,2.15,;-.42,1.38,;-1.76,2.15,;-3.09,1.38,;-3.09,-.16,;-4.42,-.93,;-4.42,-2.47,;-3.18,-3.38,;-3.65,-4.84,;-5.19,-4.84,;-5.67,-3.38,;-7.13,-2.9,;-8.28,-3.93,;-7.96,-5.44,;-9.74,-3.46,;-10.89,-4.49,;-1.76,-.93,;-.42,-.16,;.91,-.93,;.91,-2.47,;2.25,-.16,;3.58,-.93,)| Show InChI InChI=1S/C23H23Cl2N5O5/c1-5-17(31)27-13-9-35-10-14(13)28-23-26-8-11-6-12(22(32)30(2)21(11)29-23)18-19(24)15(33-3)7-16(34-4)20(18)25/h5-8,13-14H,1,9-10H2,2-4H3,(H,27,31)(H,26,28,29)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	7.5	n/a
Celgene CAR LLC; Sanofi US Patent					Assay Description Omnia Assay Protocol for Potency Assessment Against FGFR 4 Enzyme. a) [FGFR4-WT]=10 nM, [ATP]=300 uM, [Y10-Sox]=10 uM (ATP KMapp 300 uM): A 10x stock...				US Patent US9695132 (2017) BindingDB Entry DOI: 10.7270/Q2TX3CJ7
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fibroblast growth factor receptor 4 (Homo sapiens (Human))	BDBM100379 (US10189794, Compound I-211 | US10618902, Compound ...) Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(NC3COCC3NC(=O)C=C)nc2n(C)c1=O |(8.91,2.15,;7.58,1.38,;6.25,2.15,;6.25,3.69,;4.91,4.46,;4.91,6,;6.25,6.77,;3.58,3.69,;2.25,4.46,;3.58,2.15,;4.91,1.38,;4.91,-.16,;2.25,1.38,;.91,2.15,;-.42,1.38,;-1.76,2.15,;-3.09,1.38,;-3.09,-.16,;-4.42,-.93,;-4.42,-2.47,;-3.18,-3.38,;-3.65,-4.84,;-5.19,-4.84,;-5.67,-3.38,;-7.13,-2.9,;-8.28,-3.93,;-7.96,-5.44,;-9.74,-3.46,;-10.89,-4.49,;-1.76,-.93,;-.42,-.16,;.91,-.93,;.91,-2.47,;2.25,-.16,;3.58,-.93,)| Show InChI InChI=1S/C23H23Cl2N5O5/c1-5-17(31)27-13-9-35-10-14(13)28-23-26-8-11-6-12(22(32)30(2)21(11)29-23)18-19(24)15(33-3)7-16(34-4)20(18)25/h5-8,13-14H,1,9-10H2,2-4H3,(H,27,31)(H,26,28,29)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Celgene CAR LLC; Sanofi US Patent					Assay Description For MDA-MB-453 cells signaling, cells were grown in 96-well poly-D-lysine plates (BD Bioscience, San Jose, Calif.) to 90% confluence, and were then i...				US Patent US10774052 (2020)
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fibroblast growth factor receptor 4 (Homo sapiens (Human))	BDBM100379 (US10189794, Compound I-211 | US10618902, Compound ...) Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(NC3COCC3NC(=O)C=C)nc2n(C)c1=O |(8.91,2.15,;7.58,1.38,;6.25,2.15,;6.25,3.69,;4.91,4.46,;4.91,6,;6.25,6.77,;3.58,3.69,;2.25,4.46,;3.58,2.15,;4.91,1.38,;4.91,-.16,;2.25,1.38,;.91,2.15,;-.42,1.38,;-1.76,2.15,;-3.09,1.38,;-3.09,-.16,;-4.42,-.93,;-4.42,-2.47,;-3.18,-3.38,;-3.65,-4.84,;-5.19,-4.84,;-5.67,-3.38,;-7.13,-2.9,;-8.28,-3.93,;-7.96,-5.44,;-9.74,-3.46,;-10.89,-4.49,;-1.76,-.93,;-.42,-.16,;.91,-.93,;.91,-2.47,;2.25,-.16,;3.58,-.93,)| Show InChI InChI=1S/C23H23Cl2N5O5/c1-5-17(31)27-13-9-35-10-14(13)28-23-26-8-11-6-12(22(32)30(2)21(11)29-23)18-19(24)15(33-3)7-16(34-4)20(18)25/h5-8,13-14H,1,9-10H2,2-4H3,(H,27,31)(H,26,28,29)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB US Patent	n/a	n/a	<500	n/a	n/a	n/a	n/a	n/a	n/a
Celgene CAR LLC; Sanofi US Patent					Assay Description A 10× stock solution of FGFR4-WT (PR4380C or P3054), (from Invitrogen, Carlsbad, Calif.) corresponding to method a in Table 10, was prepared as descr...				US Patent US10618902 (2020)
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fibroblast growth factor receptor 4 (Homo sapiens (Human))	BDBM100379 (US10189794, Compound I-211 | US10618902, Compound ...) Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(NC3COCC3NC(=O)C=C)nc2n(C)c1=O |(8.91,2.15,;7.58,1.38,;6.25,2.15,;6.25,3.69,;4.91,4.46,;4.91,6,;6.25,6.77,;3.58,3.69,;2.25,4.46,;3.58,2.15,;4.91,1.38,;4.91,-.16,;2.25,1.38,;.91,2.15,;-.42,1.38,;-1.76,2.15,;-3.09,1.38,;-3.09,-.16,;-4.42,-.93,;-4.42,-2.47,;-3.18,-3.38,;-3.65,-4.84,;-5.19,-4.84,;-5.67,-3.38,;-7.13,-2.9,;-8.28,-3.93,;-7.96,-5.44,;-9.74,-3.46,;-10.89,-4.49,;-1.76,-.93,;-.42,-.16,;.91,-.93,;.91,-2.47,;2.25,-.16,;3.58,-.93,)| Show InChI InChI=1S/C23H23Cl2N5O5/c1-5-17(31)27-13-9-35-10-14(13)28-23-26-8-11-6-12(22(32)30(2)21(11)29-23)18-19(24)15(33-3)7-16(34-4)20(18)25/h5-8,13-14H,1,9-10H2,2-4H3,(H,27,31)(H,26,28,29)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Celgene CAR LLC; Sanofi US Patent					Assay Description A 10× stock solution of FGFR4-WT (PR4380C), (from Invitrogen, Carlsbad, Calif.) corresponding to method a in Table 7, was prepared as described below...				US Patent US10189794 (2019) BindingDB Entry DOI: 10.7270/Q2MP55BJ
					More data for this Ligand-Target Pair				3D Structure (crystal)