BDBM50463118 CHEMBL4246571

SMILES: CCCCc1ccc(cc1)-n1nnc(C(=O)N(C)C2CCS(=O)(=O)C2)c1C

InChI Key: InChIKey=QBDUMPHQYZINKK-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 = 50463118   

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)	BDBM50463118 (CHEMBL4246571) Show SMILES CCCCc1ccc(cc1)-n1nnc(C(=O)N(C)C2CCS(=O)(=O)C2)c1C Show InChI InChI=1S/C19H26N4O3S/c1-4-5-6-15-7-9-16(10-8-15)23-14(2)18(20-21-23)19(24)22(3)17-11-12-27(25,26)13-17/h7-10,17H,4-6,11-13H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	4.90E+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)	BDBM50463118 (CHEMBL4246571) Show SMILES CCCCc1ccc(cc1)-n1nnc(C(=O)N(C)C2CCS(=O)(=O)C2)c1C Show InChI InChI=1S/C19H26N4O3S/c1-4-5-6-15-7-9-16(10-8-15)23-14(2)18(20-21-23)19(24)22(3)17-11-12-27(25,26)13-17/h7-10,17H,4-6,11-13H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	3.60E+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
DNA repair protein REV1 (Homo sapiens)	BDBM50463118 (CHEMBL4246571) Show SMILES CCCCc1ccc(cc1)-n1nnc(C(=O)N(C)C2CCS(=O)(=O)C2)c1C Show InChI InChI=1S/C19H26N4O3S/c1-4-5-6-15-7-9-16(10-8-15)23-14(2)18(20-21-23)19(24)22(3)17-11-12-27(25,26)13-17/h7-10,17H,4-6,11-13H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.90E+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