BDBM50094602 CHEMBL3589010::US9284299, iCRT14::US9738628, Compound iCRT14

SMILES: Cc1cc(\C=C2/SC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1

InChI Key: InChIKey=SIWILKNHDXXHHI-FQEVSTJZSA-N

Data: 5 KI

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 5 hits for monomerid = 50094602   

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
Catenin beta-1 [138-686] (Homo sapiens (Human))	BDBM50094602 (CHEMBL3589010 | US9284299, iCRT14 | US9738628, Com...) Show SMILES Cc1cc(\C=C2/SC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1 Show InChI InChI=1S/C27H30N4/c1-18-19(2)31(20(3)21-12-6-4-7-13-21)27-24(18)26(28-23-16-10-11-17-23)29-25(30-27)22-14-8-5-9-15-22/h4-9,12-15,20,23H,10-11,16-17H2,1-3H3,(H,28,29,30)/t20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	US Patent	4.07E+4	-5.99	n/a	n/a	n/a	n/a	n/a	7.4	25
University of Utah Research Foundation US Patent					Assay Description Experiments were performed in white opaque 384-well plates from PerkinElmer (Waltham, Mass.), and the samples were read on a Synergy 2 plate reader (...				US Patent US9284299 (2016) BindingDB Entry DOI: 10.7270/Q2WW7GGC
					More data for this Ligand-Target Pair
Catenin beta-1 [138-686] (Homo sapiens (Human))	BDBM50094602 (CHEMBL3589010 | US9284299, iCRT14 | US9738628, Com...) Show SMILES Cc1cc(\C=C2/SC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1 Show InChI InChI=1S/C27H30N4/c1-18-19(2)31(20(3)21-12-6-4-7-13-21)27-24(18)26(28-23-16-10-11-17-23)29-25(30-27)22-14-8-5-9-15-22/h4-9,12-15,20,23H,10-11,16-17H2,1-3H3,(H,28,29,30)/t20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	US Patent	4.07E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Utah Research Foundation US Patent					Assay Description Experiments were performed in 96-well Microfluor 2 black plates (Waltham, Mass.), and the samples were read by a Synergy 2 plate reader (Biotek, Wino...				US Patent US9738628 (2017) BindingDB Entry DOI: 10.7270/Q27P91H7
					More data for this Ligand-Target Pair
Catenin beta-1 [138-686] (Homo sapiens (Human))	BDBM50094602 (CHEMBL3589010 | US9284299, iCRT14 | US9738628, Com...) Show SMILES Cc1cc(\C=C2/SC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1 Show InChI InChI=1S/C27H30N4/c1-18-19(2)31(20(3)21-12-6-4-7-13-21)27-24(18)26(28-23-16-10-11-17-23)29-25(30-27)22-14-8-5-9-15-22/h4-9,12-15,20,23H,10-11,16-17H2,1-3H3,(H,28,29,30)/t20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	US Patent	5.35E+4	-5.82	n/a	n/a	n/a	n/a	n/a	n/a	25
University of Utah Research Foundation US Patent					Assay Description Experiments were performed in 96-well Microfluor 2 black plates (Waltham, Mass.), and the samples were read by a Synergy 2 plate reader (Biotek, Wino...				US Patent US9284299 (2016) BindingDB Entry DOI: 10.7270/Q2WW7GGC
					More data for this Ligand-Target Pair
Catenin beta-1 [138-686] (Homo sapiens (Human))	BDBM50094602 (CHEMBL3589010 | US9284299, iCRT14 | US9738628, Com...) Show SMILES Cc1cc(\C=C2/SC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1 Show InChI InChI=1S/C27H30N4/c1-18-19(2)31(20(3)21-12-6-4-7-13-21)27-24(18)26(28-23-16-10-11-17-23)29-25(30-27)22-14-8-5-9-15-22/h4-9,12-15,20,23H,10-11,16-17H2,1-3H3,(H,28,29,30)/t20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	US Patent	5.35E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Utah Research Foundation US Patent					Assay Description Experiments were performed in white opaque 384-well plates from PerkinElmer (Waltham, Mass.), and the samples were read on a Synergy 2 plate reader (...				US Patent US9738628 (2017) BindingDB Entry DOI: 10.7270/Q27P91H7
					More data for this Ligand-Target Pair
Catenin beta-1 (Homo sapiens (Human))	BDBM50094602 (CHEMBL3589010 | US9284299, iCRT14 | US9738628, Com...) Show SMILES Cc1cc(\C=C2/SC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1 Show InChI InChI=1S/C27H30N4/c1-18-19(2)31(20(3)21-12-6-4-7-13-21)27-24(18)26(28-23-16-10-11-17-23)29-25(30-27)22-14-8-5-9-15-22/h4-9,12-15,20,23H,10-11,16-17H2,1-3H3,(H,28,29,30)/t20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	5.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Inhibition of human wild-type beta-catenin (residues 138-686)/C-terminally fluorescein labeled human wild-type Tcf4 (residues 7-51) interaction after...				J Med Chem 58: 4678-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00223 BindingDB Entry DOI: 10.7270/Q2G44S28
					More data for this Ligand-Target Pair