BDBM325249 N-(4-((2-(2-isopropylphenyl)-::US10189841, Compound I-455::US10399980, Compound I-455

SMILES: CC(C)c1ccccc1-c1ncc2n(C)c(=O)n(Cc3ccc(NS(=O)(=O)c4cn(C)c(C)n4)cc3)c2n1

InChI Key: InChIKey=XGTXVQQTESIWGC-UHFFFAOYSA-N

Data: 2 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 3 hits for monomerid = 325249   

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
Ubiquitin carboxyl-terminal hydrolase 1 (Homo sapiens (Human))	BDBM325249 (N-(4-((2-(2-isopropylphenyl)- | US10189841, Compou...) Show SMILES CC(C)c1ccccc1-c1ncc2n(C)c(=O)n(Cc3ccc(NS(=O)(=O)c4cn(C)c(C)n4)cc3)c2n1 Show InChI InChI=1S/C27H29N7O3S/c1-17(2)21-8-6-7-9-22(21)25-28-14-23-26(30-25)34(27(35)33(23)5)15-19-10-12-20(13-11-19)31-38(36,37)24-16-32(4)18(3)29-24/h6-14,16-17,31H,15H2,1-5H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<0.00200	n/a	n/a	n/a	n/a	n/a	n/a
FORMA Therapeutics, Inc. US Patent					Assay Description The HTS assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corning...				US Patent US10189841 (2019) BindingDB Entry DOI: 10.7270/Q22R3TRR
					More data for this Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 1 (Homo sapiens (Human))	BDBM325249 (N-(4-((2-(2-isopropylphenyl)- | US10189841, Compou...) Show SMILES CC(C)c1ccccc1-c1ncc2n(C)c(=O)n(Cc3ccc(NS(=O)(=O)c4cn(C)c(C)n4)cc3)c2n1 Show InChI InChI=1S/C27H29N7O3S/c1-17(2)21-8-6-7-9-22(21)25-28-14-23-26(30-25)34(27(35)33(23)5)15-19-10-12-20(13-11-19)31-38(36,37)24-16-32(4)18(3)29-24/h6-14,16-17,31H,15H2,1-5H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 1 (Homo sapiens (Human))	BDBM325249 (N-(4-((2-(2-isopropylphenyl)- | US10189841, Compou...) Show SMILES CC(C)c1ccccc1-c1ncc2n(C)c(=O)n(Cc3ccc(NS(=O)(=O)c4cn(C)c(C)n4)cc3)c2n1 Show InChI InChI=1S/C27H29N7O3S/c1-17(2)21-8-6-7-9-22(21)25-28-14-23-26(30-25)34(27(35)33(23)5)15-19-10-12-20(13-11-19)31-38(36,37)24-16-32(4)18(3)29-24/h6-14,16-17,31H,15H2,1-5H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
FORMA Therapeutics, Inc. US Patent					Assay Description The HTS assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corning...				US Patent US10399980 (2019) BindingDB Entry DOI: 10.7270/Q23J3GCX
					More data for this Ligand-Target Pair