BDBM40807 MLS000027885::N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-dimethoxy-phenyl]thiophene-2-carboxamide::N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-dimethoxyphenyl]thiophene-2-carboxamide::N-[4-[[3-(1-benzotriazolyl)-1-oxopropyl]amino]-2,5-dimethoxyphenyl]-2-thiophenecarboxamide::SMR000003916::Thiophene-2-carboxylic acid [4-(3-benzotriazol-1-yl-propionylamino)-2,5-dimethoxy-phenyl]-amide::cid_655444

SMILES: COc1cc(NC(=O)c2cccs2)c(OC)cc1NC(=O)CCn1nnc2ccccc12

InChI Key: InChIKey=ZFIIGOGSHDZHRA-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 40807   

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
Complement C1s (Homo sapiens (Human))	BDBM40807 (MLS000027885 | N-[4-[3-(benzotriazol-1-yl)propanoy...) Show SMILES COc1cc(NC(=O)c2cccs2)c(OC)cc1NC(=O)CCn1nnc2ccccc12 Show InChI InChI=1S/C22H21N5O4S/c1-30-18-13-16(24-22(29)20-8-5-11-32-20)19(31-2)12-15(18)23-21(28)9-10-27-17-7-4-3-6-14(17)25-26-27/h3-8,11-13H,9-10H2,1-2H3,(H,23,28)(H,24,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Dr. Scott L. Diamond, University of Pen...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2MP51PC
					More data for this Ligand-Target Pair