BDBM50304847 2-(1,2-dimethyl-3-oxo-5-(quinoxalin-6-yl)-2,3-dihydro-1H-pyrazol-4-yl)benzonitrile::CHEMBL603853

SMILES: Cn1c(c(-c2ccccc2C#N)c(=O)n1C)-c1ccc2nccnc2c1

InChI Key: InChIKey=HHDZHVFMSRZDLT-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 2 hits for monomerid = 50304847   

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))	BDBM50304847 (2-(1,2-dimethyl-3-oxo-5-(quinoxalin-6-yl)-2,3-dihy...) Show SMILES Cn1c(c(-c2ccccc2C#N)c(=O)n1C)-c1ccc2nccnc2c1 |(.9,-4.47,;.27,-3.07,;-1.24,-2.75,;-1.4,-1.22,;-2.74,-.45,;-4.08,-1.22,;-5.41,-.45,;-5.41,1.1,;-4.08,1.87,;-2.74,1.1,;-1.41,1.88,;-.08,2.65,;0,-.59,;.32,.92,;1.04,-1.73,;2.57,-1.57,;-2.56,-3.54,;-3.9,-2.79,;-5.22,-3.58,;-5.19,-5.12,;-6.51,-5.92,;-6.48,-7.46,;-5.13,-8.2,;-3.81,-7.41,;-3.84,-5.87,;-2.53,-5.08,)| Show InChI InChI=1S/C20H15N5O/c1-24-19(13-7-8-16-17(11-13)23-10-9-22-16)18(20(26)25(24)2)15-6-4-3-5-14(15)12-21/h3-11H,1-2H3	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec Inc. Curated by ChEMBL					Assay Description Displacement of [3H]HTS446284 from human recombinant His-tagged TGFbetaR1 after 1 hr by scintillation counting				Bioorg Med Chem Lett 20: 326-9 (2010) Article DOI: 10.1016/j.bmcl.2009.10.108 BindingDB Entry DOI: 10.7270/Q2RN37ZK
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM50304847 (2-(1,2-dimethyl-3-oxo-5-(quinoxalin-6-yl)-2,3-dihy...) Show SMILES Cn1c(c(-c2ccccc2C#N)c(=O)n1C)-c1ccc2nccnc2c1 |(.9,-4.47,;.27,-3.07,;-1.24,-2.75,;-1.4,-1.22,;-2.74,-.45,;-4.08,-1.22,;-5.41,-.45,;-5.41,1.1,;-4.08,1.87,;-2.74,1.1,;-1.41,1.88,;-.08,2.65,;0,-.59,;.32,.92,;1.04,-1.73,;2.57,-1.57,;-2.56,-3.54,;-3.9,-2.79,;-5.22,-3.58,;-5.19,-5.12,;-6.51,-5.92,;-6.48,-7.46,;-5.13,-8.2,;-3.81,-7.41,;-3.84,-5.87,;-2.53,-5.08,)| Show InChI InChI=1S/C20H15N5O/c1-24-19(13-7-8-16-17(11-13)23-10-9-22-16)18(20(26)25(24)2)15-6-4-3-5-14(15)12-21/h3-11H,1-2H3	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec Inc. Curated by ChEMBL					Assay Description Inhibition of TGFR-1 in human HepG2 cells expressing PAI-luciferase by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 326-9 (2010) Article DOI: 10.1016/j.bmcl.2009.10.108 BindingDB Entry DOI: 10.7270/Q2RN37ZK
					More data for this Ligand-Target Pair