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SMILES: Oc1ccc2c(c1)c1ccsc1[nH]c2=O

InChI Key:

PDB links: 1 PDB ID matches this monomer.

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 5 hits for monomerid = 50587474   

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
Protein mono-ADP-ribosyltransferase PARP15 (Homo sapiens (Human))	BDBM50587474 (CHEMBL5077731) Show SMILES Oc1ccc2c(c1)c1ccsc1[nH]c2=O Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PARP15 (482 to 678 residues) (unknown origin) expressed in Escherichia coli using NAD+ as substrate incubated for 3 hrs by fluorescence...				Citation and Details Article DOI: 10.1016/j.bmc.2021.116511 BindingDB Entry DOI: 10.7270/Q24B3566
					More data for this Ligand-Target Pair				3D Structure (crystal)
Protein mono-ADP-ribosyltransferase PARP14 (Homo sapiens (Human))	BDBM50587474 (CHEMBL5077731) Show SMILES Oc1ccc2c(c1)c1ccsc1[nH]c2=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PARP14 (unknown origin) using NAD+ as substrate incubated for 18 hrs by fluorescence based assay				Citation and Details Article DOI: 10.1016/j.bmc.2021.116511 BindingDB Entry DOI: 10.7270/Q24B3566
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50587474 (CHEMBL5077731) Show SMILES Oc1ccc2c(c1)c1ccsc1[nH]c2=O Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PARP2 (1 to 583 residues) (unknown origin) expressed in Escherichia coli using NAD+ as substrate by fluorescence based assay				Citation and Details Article DOI: 10.1016/j.bmc.2021.116511 BindingDB Entry DOI: 10.7270/Q24B3566
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50587474 (CHEMBL5077731) Show SMILES Oc1ccc2c(c1)c1ccsc1[nH]c2=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	129	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNKS2 (873 to 1161 residues) (unknown origin) expressed in Escherichia coli by fluorescence based assay				Citation and Details Article DOI: 10.1016/j.bmc.2021.116511 BindingDB Entry DOI: 10.7270/Q24B3566
					More data for this Ligand-Target Pair
Protein mono-ADP-ribosyltransferase PARP10 (Homo sapiens (Human))	BDBM50587474 (CHEMBL5077731) Show SMILES Oc1ccc2c(c1)c1ccsc1[nH]c2=O Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PARP10 (809 to 1017 residues) (unknown origin) expressed in Escherichia coli using NAD+ as substrate incubated for 13 hrs by fluorescen...				Citation and Details Article DOI: 10.1016/j.bmc.2021.116511 BindingDB Entry DOI: 10.7270/Q24B3566
					More data for this Ligand-Target Pair