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BDBM114635 4-chloranyl-8-methyl-N-(3-pyrrolidin-1-ylpropyl)thieno[3,2-c]quinoline-2-carboxamide::4-chloro-8-methyl-N-(3-pyrrolidin-1-ylpropyl)thieno[3,2-c]quinoline-2-carboxamide::4-chloro-8-methyl-N-(3-pyrrolidinopropyl)thieno[3,2-c]quinoline-2-carboxamide::4-chloro-8-methyl-N-[3-(1-pyrrolidinyl)propyl]-2-thieno[3,2-c]quinolinecarboxamide::MLS000731351::SMR000309626::cid_16194083

SMILES: Cc1ccc2nc(Cl)c3cc(sc3c2c1)C(=O)NCCCN1CCCC1

InChI Key: InChIKey=VDWJHBPXIGUEIN-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 114635   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Methyl-CpG-binding domain protein 2


(Homo sapiens (Human))
BDBM114635
PNG
(4-chloranyl-8-methyl-N-(3-pyrrolidin-1-ylpropyl)th...)
Show SMILES Cc1ccc2nc(Cl)c3cc(sc3c2c1)C(=O)NCCCN1CCCC1
Show InChI InChI=1S/C20H22ClN3OS/c1-13-5-6-16-14(11-13)18-15(19(21)23-16)12-17(26-18)20(25)22-7-4-10-24-8-2-3-9-24/h5-6,11-12H,2-4,7-10H2,1H3,(H,22,25)
PDB
MMDB

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PC cid
PC sid
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Similars

PCBioAssay
n/an/a 3.73E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q20K2778
More data for this
Ligand-Target Pair