BDBM50238059 CHEMBL4064820

SMILES: Fc1ccc(F)c(c1)-c1cc(Nc2ccnc3cn[nH]c23)ccn1

InChI Key: InChIKey=DUNSTQZKFKHIIG-UHFFFAOYSA-N

Data: 1 IC50  2 EC50

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 3 hits for monomerid = 50238059   

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
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM50238059 (CHEMBL4064820) Show SMILES Fc1ccc(F)c(c1)-c1cc(Nc2ccnc3cn[nH]c23)ccn1 Show InChI InChI=1S/C17H11F2N5/c18-10-1-2-13(19)12(7-10)15-8-11(3-5-20-15)23-14-4-6-21-16-9-22-24-17(14)16/h1-9H,(H,22,24)(H,20,21,23)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a
Takeda California Curated by ChEMBL					Assay Description Inhibition of ALK5 (unknown origin) expressed in SBE-bla HEK293T cells assessed as decrease in TGFbeta1-induced Smad2/3 phosphorylation by beta lacta...				Bioorg Med Chem Lett 27: 1955-1961 (2017) Article DOI: 10.1016/j.bmcl.2017.03.026 BindingDB Entry DOI: 10.7270/Q2QJ7KKZ
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM50238059 (CHEMBL4064820) Show SMILES Fc1ccc(F)c(c1)-c1cc(Nc2ccnc3cn[nH]c23)ccn1 Show InChI InChI=1S/C17H11F2N5/c18-10-1-2-13(19)12(7-10)15-8-11(3-5-20-15)23-14-4-6-21-16-9-22-24-17(14)16/h1-9H,(H,22,24)(H,20,21,23)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
Takeda California Curated by ChEMBL					Assay Description Inhibition of ALK5 in human Calu6 cells assessed as reduction in Smad2/3 phosphorylation				Bioorg Med Chem Lett 27: 1955-1961 (2017) Article DOI: 10.1016/j.bmcl.2017.03.026 BindingDB Entry DOI: 10.7270/Q2QJ7KKZ
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM50238059 (CHEMBL4064820) Show SMILES Fc1ccc(F)c(c1)-c1cc(Nc2ccnc3cn[nH]c23)ccn1 Show InChI InChI=1S/C17H11F2N5/c18-10-1-2-13(19)12(7-10)15-8-11(3-5-20-15)23-14-4-6-21-16-9-22-24-17(14)16/h1-9H,(H,22,24)(H,20,21,23)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
Takeda California Curated by ChEMBL					Assay Description Inhibition of recombinant N-terminal GST tagged human ALK5 (200 to 503 residues) expressed in baculovirus expression system using FAM-NH2-KVLTQMGSPSI...				Bioorg Med Chem Lett 27: 1955-1961 (2017) Article DOI: 10.1016/j.bmcl.2017.03.026 BindingDB Entry DOI: 10.7270/Q2QJ7KKZ
					More data for this Ligand-Target Pair