BDBM50098954 5-Prop-1-ynyl-4,5-dihydro-thieno[2,3-c]pyridin-7-ylamine::CHEMBL8302

SMILES: CC#CC1Cc2ccsc2C(N)=N1

InChI Key: InChIKey=FPIJYFMUGDPADO-UHFFFAOYSA-N

Data: 3 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 = 50098954   

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
Nitric-oxide synthase, brain (Rattus norvegicus (rat))	BDBM50098954 (5-Prop-1-ynyl-4,5-dihydro-thieno[2,3-c]pyridin-7-y...) Show SMILES CC#CC1Cc2ccsc2C(N)=N1 |c:12| Show InChI InChI=1S/C10H10N2S/c1-2-3-8-6-7-4-5-13-9(7)10(11)12-8/h4-5,8H,6H2,1H3,(H2,11,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Charnwood Curated by ChEMBL					Assay Description Ability to inhibit the conversion of [3H]-L-Arg to [3H]-L-citrulline catalyzed by n-NOS from rat cerebellum				Bioorg Med Chem Lett 11: 1027-30 (2001) BindingDB Entry DOI: 10.7270/Q2F76BT7
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50098954 (5-Prop-1-ynyl-4,5-dihydro-thieno[2,3-c]pyridin-7-y...) Show SMILES CC#CC1Cc2ccsc2C(N)=N1 |c:12| Show InChI InChI=1S/C10H10N2S/c1-2-3-8-6-7-4-5-13-9(7)10(11)12-8/h4-5,8H,6H2,1H3,(H2,11,12)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Charnwood Curated by ChEMBL					Assay Description Ability to inhibit the conversion of [3H]-L-Arg to [3H]-L-citrulline catalyzed by e-NOS from HUVECcells				Bioorg Med Chem Lett 11: 1027-30 (2001) BindingDB Entry DOI: 10.7270/Q2F76BT7
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50098954 (5-Prop-1-ynyl-4,5-dihydro-thieno[2,3-c]pyridin-7-y...) Show SMILES CC#CC1Cc2ccsc2C(N)=N1 |c:12| Show InChI InChI=1S/C10H10N2S/c1-2-3-8-6-7-4-5-13-9(7)10(11)12-8/h4-5,8H,6H2,1H3,(H2,11,12)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Charnwood Curated by ChEMBL					Assay Description Ability to inhibit the conversion of [3H]-L-Arg to [3H]-L-citrulline catalyzed by i-NOS from human DLD-1 cells				Bioorg Med Chem Lett 11: 1027-30 (2001) BindingDB Entry DOI: 10.7270/Q2F76BT7
					More data for this Ligand-Target Pair