BDBM33575 1-(2-furoyl)-3-(4-methoxyphenyl)-5-(methylthio)-1H-1,2,4-triazole::2-furanyl-[3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-1-yl]methanone::2-furyl-[3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-1-yl]methanone::MLS000049402::SMR000075338::cid_976556::furan-2-yl-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]methanone

SMILES: COc1ccc(cc1)-c1nc(SC)n(n1)C(=O)c1ccco1

InChI Key: InChIKey=WYWOFXVQVFMJML-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 = 33575   

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
Prothrombin (Homo sapiens (Human))	BDBM33575 (1-(2-furoyl)-3-(4-methoxyphenyl)-5-(methylthio)-1H...) Show SMILES COc1ccc(cc1)-c1nc(SC)n(n1)C(=O)c1ccco1 Show InChI InChI=1S/C15H13N3O3S/c1-20-11-7-5-10(6-8-11)13-16-15(22-2)18(17-13)14(19)12-4-3-9-21-12/h3-9H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.14E+3	n/a	n/a	n/a	n/a	7.5	23
PCMD Curated by PubChem BioAssay					Assay Description HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K64GDN
					More data for this Ligand-Target Pair
Complement C1s (Homo sapiens (Human))	BDBM33575 (1-(2-furoyl)-3-(4-methoxyphenyl)-5-(methylthio)-1H...) Show SMILES COc1ccc(cc1)-c1nc(SC)n(n1)C(=O)c1ccco1 Show InChI InChI=1S/C15H13N3O3S/c1-20-11-7-5-10(6-8-11)13-16-15(22-2)18(17-13)14(19)12-4-3-9-21-12/h3-9H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	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: Scott L. Diamond, University of Pennsyl...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q20000GW
					More data for this Ligand-Target Pair
Complement C1s (Homo sapiens (Human))	BDBM33575 (1-(2-furoyl)-3-(4-methoxyphenyl)-5-(methylthio)-1H...) Show SMILES COc1ccc(cc1)-c1nc(SC)n(n1)C(=O)c1ccco1 Show InChI InChI=1S/C15H13N3O3S/c1-20-11-7-5-10(6-8-11)13-16-15(22-2)18(17-13)14(19)12-4-3-9-21-12/h3-9H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.56E+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