BDBM40804 2-(6-amino-1'-benzyl-5-cyano-2'-keto-spiro[2H-pyrano[2,3-c]pyrazole-4,3'-indoline]-3-yl)acetic acid methyl ester::2-[6-amino-5-cyano-2'-oxo-1'-(phenylmethyl)-3-spiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]yl]acetic acid methyl ester::MLS000075271::SMR000014482::cid_654660::methyl 2-(6-amino-1'-benzyl-5-cyano-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-3-yl)acetate::methyl 2-[6-azanyl-5-cyano-2'-oxidanylidene-1'-(phenylmethyl)spiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-3-yl]ethanoate

SMILES: COC(=O)Cc1n[nH]c2OC(=N)C(C#N)C3(C(=O)N(Cc4ccccc4)c4ccccc34)c12

InChI Key: InChIKey=WDEDHFSOBFKYHA-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 = 40804   

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))	BDBM40804 (2-(6-amino-1'-benzyl-5-cyano-2'-keto-spiro[2H-pyra...) Show SMILES COC(=O)Cc1n[nH]c2OC(=N)C(C#N)C3(C(=O)N(Cc4ccccc4)c4ccccc34)c12 Show InChI InChI=1S/C24H19N5O4/c1-32-19(30)11-17-20-22(28-27-17)33-21(26)16(12-25)24(20)15-9-5-6-10-18(15)29(23(24)31)13-14-7-3-2-4-8-14/h2-10,16,26H,11,13H2,1H3,(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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: Dr. Scott L. Diamond, University of Pen...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2MP51PC
					More data for this Ligand-Target Pair