BDBM81478 CAS_37539-03-0::TACA

SMILES: N[C@H]1[C@H]2SCC(CSc3cnn[nH]3)=C(N2C1=O)C(O)=O

InChI Key: InChIKey=MLOZJRLUNNFSGD-HZGVNTEJSA-N

Data: 2 KI

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 = 81478   

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
Gamma-aminobutyric acid type B receptor subunit 1 (Rattus norvegicus (Rat))	BDBM81478 (CAS_37539-03-0 | TACA) Show SMILES N[C@H]1[C@H]2SCC(CSc3cnn[nH]3)=C(N2C1=O)C(O)=O |r,c:13| Show InChI InChI=1S/C10H11N5O3S2/c11-6-8(16)15-7(10(17)18)4(3-20-9(6)15)2-19-5-1-12-14-13-5/h1,6,9H,2-3,11H2,(H,17,18)(H,12,13,14)/t6-,9-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents	Article PubMed	51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by PDSP Ki Database									J Neurochem 32: 713-8 (1979) Article DOI: 10.1111/j.1471-4159.1979.tb04553.x BindingDB Entry DOI: 10.7270/Q29W0D0B
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit rho-3 (Homo sapiens (Human))	BDBM81478 (CAS_37539-03-0 | TACA) Show SMILES N[C@H]1[C@H]2SCC(CSc3cnn[nH]3)=C(N2C1=O)C(O)=O |r,c:13| Show InChI InChI=1S/C10H11N5O3S2/c11-6-8(16)15-7(10(17)18)4(3-20-9(6)15)2-19-5-1-12-14-13-5/h1,6,9H,2-3,11H2,(H,17,18)(H,12,13,14)/t6-,9-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents	Article PubMed	360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by PDSP Ki Database									Mol Pharmacol 58: 1375-80 (2000) Article DOI: 10.1124/mol.58.6.1375 BindingDB Entry DOI: 10.7270/Q2154FK5
					More data for this Ligand-Target Pair