BDBM84550 Indirubin derivative, 31a::Indirubin derivative, 31b

SMILES: CN(C)S(=O)(=O)c1ccc2NC(=O)C(C3=Nc4ccccc4C3(O)C(O)CO)c2c1

InChI Key: InChIKey=AENRCRTWVVCMEQ-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 = 84550   

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
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM84550 (Indirubin derivative, 31a | Indirubin derivative, ...) Show SMILES CN(C)S(=O)(=O)c1ccc2NC(=O)C(C3=Nc4ccccc4C3(O)C(O)CO)c2c1 |t:14| Show InChI InChI=1S/C20H21N3O6S/c1-23(2)30(28,29)11-7-8-14-12(9-11)17(19(26)22-14)18-20(27,16(25)10-24)13-5-3-4-6-15(13)21-18/h3-9,16-17,24-25,27H,10H2,1-2H3,(H,22,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	8.0	22
Schering AG					Assay Description Inhibition assay using CDK and selective kinases such as gsk3, EGFR, c-Kit, InsR and KDR.				Chembiochem 6: 531-40 (2005) Article DOI: 10.1002/cbic.200400108 BindingDB Entry DOI: 10.7270/Q2B56H8H
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM84550 (Indirubin derivative, 31a | Indirubin derivative, ...) Show SMILES CN(C)S(=O)(=O)c1ccc2NC(=O)C(C3=Nc4ccccc4C3(O)C(O)CO)c2c1 |t:14| Show InChI InChI=1S/C20H21N3O6S/c1-23(2)30(28,29)11-7-8-14-12(9-11)17(19(26)22-14)18-20(27,16(25)10-24)13-5-3-4-6-15(13)21-18/h3-9,16-17,24-25,27H,10H2,1-2H3,(H,22,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	8.0	22
Schering AG					Assay Description Inhibition assay using CDK and selective kinases such as gsk3, EGFR, c-Kit, InsR and KDR.				Chembiochem 6: 531-40 (2005) Article DOI: 10.1002/cbic.200400108 BindingDB Entry DOI: 10.7270/Q2B56H8H
					More data for this Ligand-Target Pair