BDBM50463116 CHEMBL4237457

SMILES: CCS(=O)(=O)N(C)c1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1OC

InChI Key: InChIKey=BCQGTFFXCWKNAL-UHFFFAOYSA-N

Data: 1 KI  1 IC50  1 Kd

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 = 50463116   

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
DNA repair protein REV1 (Homo sapiens)	BDBM50463116 (CHEMBL4237457) Show SMILES CCS(=O)(=O)N(C)c1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1OC Show InChI InChI=1S/C21H27N3O4S/c1-4-29(26,27)22(2)18-11-9-17(10-12-18)21(25)24-15-13-23(14-16-24)19-7-5-6-8-20(19)28-3/h5-12H,4,13-16H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Connecticut Curated by ChEMBL					Assay Description Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...				Bioorg Med Chem 26: 4301-4309 (2018) Article DOI: 10.1016/j.bmc.2018.07.029 BindingDB Entry DOI: 10.7270/Q2K93B5H
					More data for this Ligand-Target Pair
DNA repair protein REV1 (Homo sapiens)	BDBM50463116 (CHEMBL4237457) Show SMILES CCS(=O)(=O)N(C)c1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1OC Show InChI InChI=1S/C21H27N3O4S/c1-4-29(26,27)22(2)18-11-9-17(10-12-18)21(25)24-15-13-23(14-16-24)19-7-5-6-8-20(19)28-3/h5-12H,4,13-16H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Connecticut Curated by ChEMBL					Assay Description Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...				Bioorg Med Chem 26: 4301-4309 (2018) Article DOI: 10.1016/j.bmc.2018.07.029 BindingDB Entry DOI: 10.7270/Q2K93B5H
					More data for this Ligand-Target Pair
DNA repair protein REV1 (Homo sapiens)	BDBM50463116 (CHEMBL4237457) Show SMILES CCS(=O)(=O)N(C)c1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1OC Show InChI InChI=1S/C21H27N3O4S/c1-4-29(26,27)22(2)18-11-9-17(10-12-18)21(25)24-15-13-23(14-16-24)19-7-5-6-8-20(19)28-3/h5-12H,4,13-16H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a
University of Connecticut Curated by ChEMBL					Assay Description Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...				Bioorg Med Chem 26: 4301-4309 (2018) Article DOI: 10.1016/j.bmc.2018.07.029 BindingDB Entry DOI: 10.7270/Q2K93B5H
					More data for this Ligand-Target Pair