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BDBM50137910 CHEMBL434551::[3'-(naphthalene-1-yl-methylcarbamoyl)-biphenyl-4-sulfonyl]-acetic acid::{3'-[(Naphthalen-1-ylmethyl)-carbamoyl]-biphenyl-4-sulfonyl}-acetic acid

SMILES: OC(=O)CS(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(=O)NCc1cccc2ccccc12

InChI Key: InChIKey=KCTIDOMJANTHLC-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50137910   
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
Replication protein E1


(Human papillomavirus type 11)
BDBM50137910
PNG
(CHEMBL434551 | [3'-(naphthalene-1-yl-methylcarbamo...)
Show SMILES OC(=O)CS(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(=O)NCc1cccc2ccccc12
Show InChI InChI=1S/C26H21NO5S/c28-25(29)17-33(31,32)23-13-11-18(12-14-23)20-7-4-8-21(15-20)26(30)27-16-22-9-3-6-19-5-1-2-10-24(19)22/h1-15H,16-17H2,(H,27,30)(H,28,29)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.30n/an/an/an/an/an/a



Boehringer Ingelheim (Canada) Ltd.

Curated by ChEMBL


Assay Description
Binding affinity for human papillomavirus (HPV6) E1 helicase


J Med Chem 47: 18-21 (2003)


Article DOI: 10.1021/jm034206x
BindingDB Entry DOI: 10.7270/Q23F4P2Q
More data for this
Ligand-Target Pair
Replication protein E1


(Human papillomavirus type 11)
BDBM50137910
PNG
(CHEMBL434551 | [3'-(naphthalene-1-yl-methylcarbamo...)
Show SMILES OC(=O)CS(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(=O)NCc1cccc2ccccc12
Show InChI InChI=1S/C26H21NO5S/c28-25(29)17-33(31,32)23-13-11-18(12-14-23)20-7-4-8-21(15-20)26(30)27-16-22-9-3-6-19-5-1-2-10-24(19)22/h1-15H,16-17H2,(H,27,30)(H,28,29)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.30n/an/an/an/an/an/a



Boehringer Ingelheim (Canada) Ltd.

Curated by ChEMBL


Assay Description
Ability to inhibit in vitro ATPase activity of human papillomavirus (HPV6) E1 helicase


J Med Chem 47: 18-21 (2003)


Article DOI: 10.1021/jm034206x
BindingDB Entry DOI: 10.7270/Q23F4P2Q
More data for this
Ligand-Target Pair