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BDBM50196679 CHEMBL388742::N-(1-(2-chlorobenzyl)pyrrolidin-3-yl)-1H-indazol-5-amine::N-[1-(2-chlorobenzyl)-3-pyrrolidyl]-N-(1H-5-indazolyl)amine

SMILES: Clc1ccccc1CN1CCC(C1)Nc1ccc2[nH]ncc2c1

InChI Key: InChIKey=JQHQSWUFSHQDHF-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50196679   
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
Rho-associated protein kinase 2/Rho-kinase (ROCK I)


(Homo sapiens (Human))
BDBM50196679
PNG
(CHEMBL388742 | N-(1-(2-chlorobenzyl)pyrrolidin-3-y...)
Show SMILES Clc1ccccc1CN1CCC(C1)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C18H19ClN4/c19-17-4-2-1-3-13(17)11-23-8-7-16(12-23)21-15-5-6-18-14(9-15)10-20-22-18/h1-6,9-10,16,21H,7-8,11-12H2,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 45n/an/an/an/an/an/a



Kirin Brewery Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of Rho kinase


Bioorg Med Chem 15: 350-64 (2006)


Article DOI: 10.1016/j.bmc.2006.09.052
BindingDB Entry DOI: 10.7270/Q2T43TW5
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50196679
PNG
(CHEMBL388742 | N-(1-(2-chlorobenzyl)pyrrolidin-3-y...)
Show SMILES Clc1ccccc1CN1CCC(C1)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C18H19ClN4/c19-17-4-2-1-3-13(17)11-23-8-7-16(12-23)21-15-5-6-18-14(9-15)10-20-22-18/h1-6,9-10,16,21H,7-8,11-12H2,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



Kirin Brewery Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MCP1-induced cell migration in U937 cells expressing CCR2 by chemotaxis assay


Bioorg Med Chem 15: 350-64 (2006)


Article DOI: 10.1016/j.bmc.2006.09.052
BindingDB Entry DOI: 10.7270/Q2T43TW5
More data for this
Ligand-Target Pair