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BDBM322180 N-(2-(4-(1-aminoethyl)phenyl)pyrimidin-4-yl)-1H-indazol-5-amine::US10183931, Example 150

SMILES: CC(N)c1ccc(cc1)-c1nccc(Nc2ccc3[nH]ncc3c2)n1

InChI Key: InChIKey=CWUIXINUMSSEAL-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 = 322180   
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 1


(Homo sapiens (human))
BDBM322180
PNG
(N-(2-(4-(1-aminoethyl)phenyl)pyrimidin-4-yl)-1H-in...)
Show SMILES CC(N)c1ccc(cc1)-c1nccc(Nc2ccc3[nH]ncc3c2)n1
Show InChI InChI=1S/C19H18N6/c1-12(20)13-2-4-14(5-3-13)19-21-9-8-18(24-19)23-16-6-7-17-15(10-16)11-22-25-17/h2-12H,20H2,1H3,(H,22,25)(H,21,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+3n/an/an/an/an/an/a



Kadmon Corporation, LLC

US Patent


Assay Description
Dose response curves for Rho-kinase inhibition were derived from a Millipore immuno-based 96 well plate assay (Millipore catalog number CSA001). Puri...


US Patent US10183931 (2019)

More data for this
Ligand-Target Pair
Rho-associated protein kinase 2


(Homo sapiens (Human))
BDBM322180
PNG
(N-(2-(4-(1-aminoethyl)phenyl)pyrimidin-4-yl)-1H-in...)
Show SMILES CC(N)c1ccc(cc1)-c1nccc(Nc2ccc3[nH]ncc3c2)n1
Show InChI InChI=1S/C19H18N6/c1-12(20)13-2-4-14(5-3-13)19-21-9-8-18(24-19)23-16-6-7-17-15(10-16)11-22-25-17/h2-12H,20H2,1H3,(H,22,25)(H,21,23,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.00E+3n/an/an/an/an/an/a



Kadmon Corporation, LLC

US Patent


Assay Description
Dose response curves for Rho-kinase inhibition were derived from a Millipore immuno-based 96 well plate assay (Millipore catalog number CSA001). Puri...


US Patent US10183931 (2019)

More data for this
Ligand-Target Pair