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SMILES: CN1CCc2ccc(Cl)cc2C1c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1

InChI Key:

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 = 50575607   
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
SUMO-activating enzyme subunit 1/2


(Homo sapiens (Human))
BDBM50575607
PNG
(CHEMBL4861656)
Show SMILES CN1CCc2ccc(Cl)cc2C1c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.5n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01491
BindingDB Entry DOI: 10.7270/Q2PK0KZ8
More data for this
Ligand-Target Pair
SUMO-activating enzyme subunit 1/2


(Homo sapiens (Human))
BDBM50575607
PNG
(CHEMBL4861656)
Show SMILES CN1CCc2ccc(Cl)cc2C1c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 638n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01491
BindingDB Entry DOI: 10.7270/Q2PK0KZ8
More data for this
Ligand-Target Pair
NEDD8-activating enzyme E1 catalytic subunit


(Homo sapiens)
BDBM50575607
PNG
(CHEMBL4861656)
Show SMILES CN1CCc2ccc(Cl)cc2C1c1csc(c1)C(=O)c1cncnc1N[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)C1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01491
BindingDB Entry DOI: 10.7270/Q2PK0KZ8
More data for this
Ligand-Target Pair