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BDBM282858 (R)-6-(4-(3-chloro-4-fluorophenyl)-1-(3,3- difluorocyclopentyl)-1H-imidazol-5-yl)imidazo[1,2- b]pyridazine-3-carbonitrile::US10287295, Example 63'::US9884868, Example 63'

SMILES: Fc1ccc(cc1Cl)-c1ncn([C@@H]2CCC(F)(F)C2)c1-c1ccc2ncc(C#N)n2n1

InChI Key: InChIKey=LUABADMUPNRBMU-CYBMUJFWSA-N

Data: 4 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 4 hits for monomerid = 282858   
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
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM282858
PNG
((R)-6-(4-(3-chloro-4-fluorophenyl)-1-(3,3- difluor...)
Show SMILES Fc1ccc(cc1Cl)-c1ncn([C@@H]2CCC(F)(F)C2)c1-c1ccc2ncc(C#N)n2n1 |r|
Show InChI InChI=1S/C21H14ClF3N6/c22-15-7-12(1-2-16(15)23)19-20(30(11-28-19)13-5-6-21(24,25)8-13)17-3-4-18-27-10-14(9-26)31(18)29-17/h1-4,7,10-11,13H,5-6,8H2/t13-/m1/s1
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.900n/an/an/an/a7.425



Rigel Pharmaceuticals, Inc.; Bristol-Myers Squibb Company

US Patent


Assay Description
Assays for the compounds reported below were conducted in 1536-well plates and 2 mL reactions are prepared from addition of HIS-TGF-βR1 T204D or...


US Patent US9884868 (2018)


BindingDB Entry DOI: 10.7270/Q20P122M
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens (Human))
BDBM282858
PNG
((R)-6-(4-(3-chloro-4-fluorophenyl)-1-(3,3- difluor...)
Show SMILES Fc1ccc(cc1Cl)-c1ncn([C@@H]2CCC(F)(F)C2)c1-c1ccc2ncc(C#N)n2n1 |r|
Show InChI InChI=1S/C21H14ClF3N6/c22-15-7-12(1-2-16(15)23)19-20(30(11-28-19)13-5-6-21(24,25)8-13)17-3-4-18-27-10-14(9-26)31(18)29-17/h1-4,7,10-11,13H,5-6,8H2/t13-/m1/s1
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 8.77E+3n/an/an/an/an/an/a



University of Wisconsin at Madison



Assay Description
Assays for the compounds reported below were conducted in 1536-well plates and 2 mL reactions are prepared from addition of HIS-TGF-βR1 T204D or...


J Med Chem 51: 7243-52 (2008)


BindingDB Entry DOI: 10.7270/Q2B85BFB
More data for this
Ligand-Target Pair
TGF-betaR1 T204D


(Homo sapiens (Human))
BDBM282858
PNG
((R)-6-(4-(3-chloro-4-fluorophenyl)-1-(3,3- difluor...)
Show SMILES Fc1ccc(cc1Cl)-c1ncn([C@@H]2CCC(F)(F)C2)c1-c1ccc2ncc(C#N)n2n1 |r|
Show InChI InChI=1S/C21H14ClF3N6/c22-15-7-12(1-2-16(15)23)19-20(30(11-28-19)13-5-6-21(24,25)8-13)17-3-4-18-27-10-14(9-26)31(18)29-17/h1-4,7,10-11,13H,5-6,8H2/t13-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

B.MOAD
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PC cid
PC sid
UniChem
US Patent
n/an/a 0.900n/an/an/an/an/an/a



University of Wisconsin at Madison



Assay Description
Assays for the compounds reported below were conducted in 1536-well plates and 2 mL reactions are prepared from addition of HIS-TGF-βR1 T204D or...


J Med Chem 51: 7243-52 (2008)


BindingDB Entry DOI: 10.7270/Q2B85BFB
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens (Human))
BDBM282858
PNG
((R)-6-(4-(3-chloro-4-fluorophenyl)-1-(3,3- difluor...)
Show SMILES Fc1ccc(cc1Cl)-c1ncn([C@@H]2CCC(F)(F)C2)c1-c1ccc2ncc(C#N)n2n1 |r|
Show InChI InChI=1S/C21H14ClF3N6/c22-15-7-12(1-2-16(15)23)19-20(30(11-28-19)13-5-6-21(24,25)8-13)17-3-4-18-27-10-14(9-26)31(18)29-17/h1-4,7,10-11,13H,5-6,8H2/t13-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 8.77E+3n/an/an/an/an/an/a



Rigel Pharmaceuticals, Inc.; Bristol-Myers Squibb Company

US Patent




US Patent US9884868 (2018)


BindingDB Entry DOI: 10.7270/Q20P122M
More data for this
Ligand-Target Pair