BDBM50275870 CHEMBL4129331

SMILES: Clc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

InChI Key: InChIKey=HNXRNVIOVADQKE-UHFFFAOYSA-N

Data: 2 KI  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 3 hits for monomerid = 50275870   

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
Intestinal alkaline phosphatase (Bos taurus (Cattle))	BDBM50275870 (CHEMBL4129331) Show SMILES Clc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 Show InChI InChI=1S/C18H14ClN5O3S2/c19-13-4-2-12(3-5-13)16(25)23-18(28)22-14-6-8-15(9-7-14)29(26,27)24-17-20-10-1-11-21-17/h1-11H,(H,20,21,24)(H2,22,23,25,28)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	115	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Quaid-i-Azam University Curated by ChEMBL					Assay Description Mixed-type inhibition of calf intestinal alkaline phosphatase assessed as enzyme-inhibitor dissociation constant using varying levels of p-NPP as sub...				Bioorg Med Chem 26: 3707-3715 (2018) Article DOI: 10.1016/j.bmc.2018.06.002 BindingDB Entry DOI: 10.7270/Q2C53PBN
					More data for this Ligand-Target Pair
Intestinal alkaline phosphatase (Bos taurus (Cattle))	BDBM50275870 (CHEMBL4129331) Show SMILES Clc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 Show InChI InChI=1S/C18H14ClN5O3S2/c19-13-4-2-12(3-5-13)16(25)23-18(28)22-14-6-8-15(9-7-14)29(26,27)24-17-20-10-1-11-21-17/h1-11H,(H,20,21,24)(H2,22,23,25,28)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	415	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Quaid-i-Azam University Curated by ChEMBL					Assay Description Mixed-type inhibition of calf intestinal alkaline phosphatase assessed as enzyme-substrate-inhibitor dissociation constant using varying levels of p-...				Bioorg Med Chem 26: 3707-3715 (2018) Article DOI: 10.1016/j.bmc.2018.06.002 BindingDB Entry DOI: 10.7270/Q2C53PBN
					More data for this Ligand-Target Pair
Intestinal alkaline phosphatase (Bos taurus (Cattle))	BDBM50275870 (CHEMBL4129331) Show SMILES Clc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 Show InChI InChI=1S/C18H14ClN5O3S2/c19-13-4-2-12(3-5-13)16(25)23-18(28)22-14-6-8-15(9-7-14)29(26,27)24-17-20-10-1-11-21-17/h1-11H,(H,20,21,24)(H2,22,23,25,28)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
Quaid-i-Azam University Curated by ChEMBL					Assay Description Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...				Bioorg Med Chem 26: 3707-3715 (2018) Article DOI: 10.1016/j.bmc.2018.06.002 BindingDB Entry DOI: 10.7270/Q2C53PBN
					More data for this Ligand-Target Pair