BDBM114663 3-(1-amino-9,10-dioxoanthracen-2-yl)sulfanylpropanoic acid::3-[(1-amino-9,10-diketo-2-anthryl)thio]propionic acid::3-[(1-amino-9,10-dioxo-2-anthracenyl)thio]propanoic acid::3-[1-azanyl-9,10-bis(oxidanylidene)anthracen-2-yl]sulfanylpropanoic acid::MLS001164928::SMR000540155::cid_4356619

SMILES: Nc1c(SCCC(O)=O)ccc2C(=O)c3ccccc3C(=O)c12

InChI Key: InChIKey=LSJCXXCIUNFOBN-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 114663   

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
Fibrinogen beta chain [164-491] (Homo sapiens (Human))	BDBM114663 (3-(1-amino-9,10-dioxoanthracen-2-yl)sulfanylpropan...) Show SMILES Nc1c(SCCC(O)=O)ccc2C(=O)c3ccccc3C(=O)c12 Show InChI InChI=1S/C17H13NO4S/c18-15-12(23-8-7-13(19)20)6-5-11-14(15)17(22)10-4-2-1-3-9(10)16(11)21/h1-6H,7-8,18H2,(H,19,20)	PDB MMDB Reactome pathway B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	8.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2R49PFB
					More data for this Ligand-Target Pair
Fibrinogen beta chain [164-491] (Homo sapiens (Human))	BDBM114663 (3-(1-amino-9,10-dioxoanthracen-2-yl)sulfanylpropan...) Show SMILES Nc1c(SCCC(O)=O)ccc2C(=O)c3ccccc3C(=O)c12 Show InChI InChI=1S/C17H13NO4S/c18-15-12(23-8-7-13(19)20)6-5-11-14(15)17(22)10-4-2-1-3-9(10)16(11)21/h1-6H,7-8,18H2,(H,19,20)	PDB MMDB Reactome pathway B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	1.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2VX0F59
					More data for this Ligand-Target Pair