BDBM76228 1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(phenylmethyl)thiourea::1-(3,4-dihydro-2H-thiochromen-4-yl)-3-(phenylmethyl)thiourea::1-benzyl-3-(3,4-dihydro-2H-thiochromen-4-yl)thiourea::1-benzyl-3-thiochroman-4-yl-thiourea::MLS001143039::SMR000688458::cid_24684580

SMILES: S=C(NCc1ccccc1)NC1CCSc2ccccc12

InChI Key: InChIKey=XZJBTVHABBDODG-UHFFFAOYSA-N

Data: 3 IC50  1 EC50

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 4 hits for monomerid = 76228   

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 (Homo sapiens (Human))	BDBM76228 (1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(phenyl...) Show SMILES S=C(NCc1ccccc1)NC1CCSc2ccccc12 Show InChI InChI=1S/C17H18N2S2/c20-17(18-12-13-6-2-1-3-7-13)19-15-10-11-21-16-9-5-4-8-14(15)16/h1-9,15H,10-12H2,(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	6.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2X63KDM
					More data for this Ligand-Target Pair
Alpi (Rattus norvegicus (Rat))	BDBM76228 (1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(phenyl...) Show SMILES S=C(NCc1ccccc1)NC1CCSc2ccccc12 Show InChI InChI=1S/C17H18N2S2/c20-17(18-12-13-6-2-1-3-7-13)19-15-10-11-21-16-9-5-4-8-14(15)16/h1-9,15H,10-12H2,(H2,18,19,20)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2DB809V
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM76228 (1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(phenyl...) Show SMILES S=C(NCc1ccccc1)NC1CCSc2ccccc12 Show InChI InChI=1S/C17H18N2S2/c20-17(18-12-13-6-2-1-3-7-13)19-15-10-11-21-16-9-5-4-8-14(15)16/h1-9,15H,10-12H2,(H2,18,19,20)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	4.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2H130G1
					More data for this Ligand-Target Pair
Alkaline phosphatase placental-like (Homo sapiens (Human))	BDBM76228 (1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(phenyl...) Show SMILES S=C(NCc1ccccc1)NC1CCSc2ccccc12 Show InChI InChI=1S/C17H18N2S2/c20-17(18-12-13-6-2-1-3-7-13)19-15-10-11-21-16-9-5-4-8-14(15)16/h1-9,15H,10-12H2,(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2SJ1J25
					More data for this Ligand-Target Pair