BDBM233164 Carbocyclic minor groove binder, 6

SMILES: Nc1cccc(c1)C(=O)Nc1cccc(c1)C(=O)NCCCCCNC(=O)c1cccc(NC(=O)c2cccc(N)c2)c1

InChI Key: InChIKey=YYUWRPDHTXYOHR-UHFFFAOYSA-N

Data: 3 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 = 233164   

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
Urokinase-type plasminogen activator (Homo sapiens (Human))	BDBM233164 (Carbocyclic minor groove binder, 6) Show SMILES Nc1cccc(c1)C(=O)Nc1cccc(c1)C(=O)NCCCCCNC(=O)c1cccc(NC(=O)c2cccc(N)c2)c1 Show InChI InChI=1S/C33H34N6O4/c34-26-12-4-8-22(18-26)32(42)38-28-14-6-10-24(20-28)30(40)36-16-2-1-3-17-37-31(41)25-11-7-15-29(21-25)39-33(43)23-9-5-13-27(35)19-23/h4-15,18-21H,1-3,16-17,34-35H2,(H,36,40)(H,37,41)(H,38,42)(H,39,43)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Medical University					Assay Description Quantities of 0.2 mL of examined preparation (as control, 0.15 M NaCl), buffer, and 0.1 mL of enzyme solution were mixed together. The mixture was in...				J Enzyme Inhib Med Chem 25: 629-34 (2010) Article DOI: 10.3109/14756360903389872 BindingDB Entry DOI: 10.7270/Q2SB44NW
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM233164 (Carbocyclic minor groove binder, 6) Show SMILES Nc1cccc(c1)C(=O)Nc1cccc(c1)C(=O)NCCCCCNC(=O)c1cccc(NC(=O)c2cccc(N)c2)c1 Show InChI InChI=1S/C33H34N6O4/c34-26-12-4-8-22(18-26)32(42)38-28-14-6-10-24(20-28)30(40)36-16-2-1-3-17-37-31(41)25-11-7-15-29(21-25)39-33(43)23-9-5-13-27(35)19-23/h4-15,18-21H,1-3,16-17,34-35H2,(H,36,40)(H,37,41)(H,38,42)(H,39,43)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Medical University					Assay Description Quantities of 0.2 mL of examined preparation (as control, 0.15 M NaCl), buffer, and 0.1 mL of enzyme solution were mixed together. The mixture was in...				J Enzyme Inhib Med Chem 25: 629-34 (2010) Article DOI: 10.3109/14756360903389872 BindingDB Entry DOI: 10.7270/Q2SB44NW
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM233164 (Carbocyclic minor groove binder, 6) Show SMILES Nc1cccc(c1)C(=O)Nc1cccc(c1)C(=O)NCCCCCNC(=O)c1cccc(NC(=O)c2cccc(N)c2)c1 Show InChI InChI=1S/C33H34N6O4/c34-26-12-4-8-22(18-26)32(42)38-28-14-6-10-24(20-28)30(40)36-16-2-1-3-17-37-31(41)25-11-7-15-29(21-25)39-33(43)23-9-5-13-27(35)19-23/h4-15,18-21H,1-3,16-17,34-35H2,(H,36,40)(H,37,41)(H,38,42)(H,39,43)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Medical University					Assay Description Quantities of 0.2 mL of examined preparation (as control, 0.15 M NaCl), buffer, and 0.1 mL of enzyme solution were mixed together. The mixture was in...				J Enzyme Inhib Med Chem 25: 629-34 (2010) Article DOI: 10.3109/14756360903389872 BindingDB Entry DOI: 10.7270/Q2SB44NW
					More data for this Ligand-Target Pair