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Compile Data Set for Download or QSAR

Found 120 hits of ic50 for UniProtKB: P11802   
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
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515983
PNG
(US11053238, Com. EX. 6)
Show SMILES CC1(C)CCCc2nc3c(F)cc(cc3n12)-c1nc(Nc2ccc(CN3CCNCC3)cn2)ncc1F
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515951
PNG
(US11053238, Com. EX. 5)
Show SMILES CC1(C)CCCc2nc3c(F)cc(cc3n12)-c1nc(Nc2ccc(cn2)N2CCN(CC2)C2COC2)ncc1F
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 17n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM50110183
PNG
(Abemaciclib | LY-2835219 | US10626107, Example LY2...)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc(C)n(C(C)C)c4c3)nc2)CC1
Show InChI InChI=1S/C27H32F2N8/c1-5-35-8-10-36(11-9-35)16-19-6-7-24(30-14-19)33-27-31-15-22(29)25(34-27)20-12-21(28)26-23(13-20)37(17(2)3)18(4)32-26/h6-7,12-15,17H,5,8-11,16H2,1-4H3,(H,30,31,33,34)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
US Patent
n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM516039
PNG
(US11053238, Compound 2a | US11053238, Compound 2b)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2cc(F)c3nc4CCCCn4c3c2)nc1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM50110183
PNG
(Abemaciclib | LY-2835219 | US10626107, Example LY2...)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc(C)n(C(C)C)c4c3)nc2)CC1
Show InChI InChI=1S/C27H32F2N8/c1-5-35-8-10-36(11-9-35)16-19-6-7-24(30-14-19)33-27-31-15-22(29)25(34-27)20-12-21(28)26-23(13-20)37(17(2)3)18(4)32-26/h6-7,12-15,17H,5,8-11,16H2,1-4H3,(H,30,31,33,34)
PDB

UniProtKB/SwissProt

antibodypedia
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Purchase

MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
US Patent
n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515904
PNG
(4-(6-fluoro-1- methyl-1,2,3,4- tetrahydrobenzo[4,5...)
Show SMILES CC1CCCc2nc3c(F)cc(cc3n12)-c1ccnc(Nc2ccc(cn2)N2CCN(C)CC2)n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM516275
PNG
(US11053238, Compound 15b)
Show SMILES C[C@H]1COCc2nc3c(F)cc(cc3n12)-c1nc(Nc2ccc(cn2)N2CCN(C)CC2)ncc1F |r|
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM516028
PNG
(US11053238, Compound 1a | US11053238, Compound 1b)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2cc(F)c3nc4CCCC5(CC5)n4c3c2)nc1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515904
PNG
(4-(6-fluoro-1- methyl-1,2,3,4- tetrahydrobenzo[4,5...)
Show SMILES CC1CCCc2nc3c(F)cc(cc3n12)-c1ccnc(Nc2ccc(cn2)N2CCN(C)CC2)n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515905
PNG
(N-(5-((4-ethylpiperazin- 1-yl)methyl) pyridin-2-yl...)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc5CCCC(C)n5c4c3)nc2)CC1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 31n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515923
PNG
(US11053238, Compound 16b | US11053238, Example 16b)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc5COC[C@H](C)n5c4c3)nc2)CC1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 40n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515923
PNG
(US11053238, Compound 16b | US11053238, Example 16b)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc5COC[C@H](C)n5c4c3)nc2)CC1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 45n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM516039
PNG
(US11053238, Compound 2a | US11053238, Compound 2b)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2cc(F)c3nc4CCCCn4c3c2)nc1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 108n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM515986
PNG
(US11053238, Com. EX. No. 7)
Show SMILES CC1CCCn2c1nc1c(F)cc(cc21)-c1ccnc(Nc2ccc(cn2)N2CCN(C)CC2)n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 110n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM516028
PNG
(US11053238, Compound 1a | US11053238, Compound 1b)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2cc(F)c3nc4CCCC5(CC5)n4c3c2)nc1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 121n/an/an/an/an/an/a


TBA

Assay Description
To demonstrate that the compounds exhibit affinity for CDK kinases (CDK2/CycA2, CDK4/CycD3, CDK6/cycD3), CDK kinase assays were performed.Reaction bu...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2959MRV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648803
PNG
(8-(2,2-difluoro-6-azaspiro[3.4]octan-6-yl)-N-(1- (...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ncc2ccnc(N3CCC4(CC(F)(F)C4)C3)c2n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
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PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648804
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N-(1- ...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ncc2ccnc(N3CCC4(CC4(F)F)C3)c2n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
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PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648806
PNG
(3-cyclopropyl-1-(2-((1-(methylsulfonyl)piperidin- ...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ncc2ccnc(N3CCC(C3)(C#N)C3CC3)c2n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
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AffyNet 
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PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648807
PNG
(8-(2,2-difluoro-6-azaspiro[3.4]octan-6-yl)-N-(5-(6...)
Show SMILES CCN1CC2(C1)CN(C2)c1ccc(Nc2ncc3ccnc(N4CCC5(CC(F)(F)C5)C4)c3n2)nc1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
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PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648808
PNG
(N-(1-(methylsulfonyl)piperidin-4-yl)-8-(8-oxa-2- a...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ncc2ccnc(N3CCC4(C3)CCOCC4)c2n1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648811
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N-(5- ...)
Show SMILES CN1CCn2nc(Nc3ncc4ccnc(N5CCC6(CC6(F)F)C5)c4n3)cc2C1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
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PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648812
PNG
(8-(8,8-difluoro-2-(methyl-d3)-2,6- diazaspiro[3.4]...)
Show SMILES CN1CC2(C1)CN(CC2(F)F)c1nc(C)cc2cnc(NC3CCN(CC3)S(=O)(=O)c3cnn(C)c3)nc12
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
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AffyNet 
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PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648813
PNG
(8-(8,8-difluoro-2-(methyl-d3)-2,6- diazaspiro[3.4]...)
Show SMILES CN1CC2(C1)CN(CC2(F)F)c1nc(C)cc2cnc(NC3CCN(CC3)S(C)(=O)=O)nc12
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648814
PNG
(N-(1-(cyclopropylsulfonyl)piperidin-4-yl)-8-(8,8- ...)
Show SMILES CN1CC2(C1)CN(CC2(F)F)c1nc(C)cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc12
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
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UniChem
n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648815
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N-(1- ...)
Show SMILES CS(=O)(=O)N1CC(C1)Nc1ncc2ccnc(N3CCC4(CC4(F)F)C3)c2n1
PDB

UniProtKB/SwissProt

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antibodypedia
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n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648817
PNG
((3aR,8bR)-2-(2-((1-(methylsulfonyl)piperidin-4- yl...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ncc2ccnc(C3C[C@@H]4[C@H](C3)S(=O)(=O)c3ccccc43)c2n1 |r|
PDB

UniProtKB/SwissProt

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n/an/a<200n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648818
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N- ((1...)
Show SMILES CN1C[C@H]2[C@@H](C1)[C@@H]2Nc1ncc2ccnc(N3CCC4(CC4(F)F)C3)c2n1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a<200n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648821
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N-(1- ...)
Show SMILES CN1CCC(CC1)n1cc(Nc2ncc3ccnc(N4CCC5(CC5(F)F)C4)c3n2)cn1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a<200n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648822
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N-(5- ...)
Show SMILES CCN1CC2(C1)CN(C2)c1ccc(Nc2ncc3ccnc(N4CCC5(CC5(F)F)C4)c3n2)nc1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a<200n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648823
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N-(2- ...)
Show SMILES CN1Cc2ccc(Nc3ncc4ccnc(N5CCC6(CC6(F)F)C5)c4n3)nc2C1
PDB

UniProtKB/SwissProt

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n/an/a<200n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648824
PNG
(N-(2-methylisoindolin-5-yl)-8-(7- (methylsulfonyl)...)
Show SMILES CN1Cc2ccc(Nc3ncc4ccnc(N5CCC6(CCN(C6)S(C)(=O)=O)C5)c4n3)cc2C1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a<200n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648825
PNG
(6-(2-((2-methylisoindolin-5-yl)amino)pyrido[3,4- d...)
Show SMILES CN1Cc2ccc(Nc3ncc4ccnc(N5CC6(C5)CS(=O)(=O)C6)c4n3)cc2C1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648826
PNG
(N-(1-(cyclopropylsulfonyl)piperidin-4-yl)-6- methy...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc2c(n1)N1CC2(C1)CCNC2
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648829
PNG
(3-cyclopropyl-1-(6-methyl-2-((4-(6-methyl-2,6- dia...)
Show SMILES CN1CC2(C1)CN(C2)c1ccc(Nc2ncc3cc(C)nc(N4CCC(C4)(C#N)C4CC4)c3n2)cc1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648834
PNG
(N-(1-(cyclopropylsulfonyl)piperidin-4-yl)-6- methy...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc2c(n1)N1CC2(CNC2)C1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648835
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-6- met...)
Show SMILES CN1CC2(CC(C2)n2cc(Nc3ncc4cc(C)nc(N5CCC6(CC6(F)F)C5)c4n3)cn2)C1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648836
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-6- met...)
Show SMILES CN1CC2(C1)CN(C2)c1ccc(Nc2ncc3cc(C)nc(N4CCC5(CC5(F)F)C4)c3n2)cc1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648837
PNG
(6-methyl-N-(4-(6-methyl-2,6- diazaspiro[3.3]heptan...)
Show SMILES CN1CC2(C1)CN(C2)c1ccc(Nc2ncc3cc(C)nc(N4CCC5(C4)CCOCC5)c3n2)cc1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648842
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-N- ((1...)
Show SMILES CN(C)C[C@H]1CC[C@@H](CC1)Nc1ncc2cc(C)nc(N3CCC4(CC4(F)F)C3)c2n1 |r,wU:7.10,wD:4.3,(-8.46,-4.26,;-7.13,-3.49,;-7.13,-1.95,;-5.79,-4.26,;-4.46,-3.49,;-3.13,-4.26,;-1.79,-3.49,;-1.79,-1.95,;-3.13,-1.18,;-4.46,-1.95,;-.46,-1.18,;.88,-1.95,;.88,-3.49,;2.21,-4.26,;3.54,-3.49,;4.88,-4.26,;6.21,-3.49,;7.54,-4.26,;6.21,-1.95,;4.88,-1.18,;4.88,.36,;3.63,1.26,;4.11,2.73,;5.65,2.73,;5.81,4.26,;7.05,3.36,;8.3,2.45,;8.46,3.98,;6.12,1.26,;3.54,-1.95,;2.21,-1.18,)|
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648843
PNG
(8-(1,1-difluoro-5-azaspiro[2.4]heptan-5-yl)-6- met...)
Show SMILES Cc1cc2cnc(NC3CCC(CC3)S(C)(=O)=O)nc2c(n1)N1CCC2(CC2(F)F)C1 |(6.88,-3.59,;5.54,-2.82,;4.21,-3.59,;2.88,-2.82,;1.54,-3.59,;.21,-2.82,;.21,-1.28,;-1.13,-.51,;-2.46,-1.28,;-3.79,-.51,;-5.13,-1.28,;-5.13,-2.82,;-3.79,-3.59,;-2.46,-2.82,;-6.46,-3.59,;-7.79,-4.36,;-7.23,-2.26,;-5.69,-4.93,;1.54,-.51,;2.88,-1.28,;4.21,-.51,;5.54,-1.28,;4.21,1.03,;2.96,1.93,;3.44,3.4,;4.98,3.4,;5.14,4.93,;6.39,4.02,;7.63,3.12,;7.79,4.65,;5.46,1.93,)|
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648852
PNG
(1-(cyclopropanesulfonyl)-N-(8-{2,6- diazaspiro[3.4...)
Show SMILES FC(F)c1cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc2c(n1)N1CC2(C1)CCNC2
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648853
PNG
(N-(2-cyclopropylisoindolin-5-yl)-6-methyl-8-(2,6- ...)
Show SMILES Cc1cc2cnc(Nc3ccc4CN(Cc4c3)C3CC3)nc2c(n1)N1CC2(C1)CCNC2
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648856
PNG
(N-(2-cyclopropylisoindolin-5-yl)-6- (difluoromethy...)
Show SMILES FC(F)c1cc2cnc(Nc3ccc4CN(Cc4c3)C3CC3)nc2c(n1)N1CC2(C1)CCNC2
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648858
PNG
(8-(1,1-difluoro-6-azaspiro[3.4]octan-6-yl)-6- meth...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(C)(=O)=O)nc2c(n1)N1CCC2(CCC2(F)F)C1
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More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648859
PNG
(8-(2,2-difluoro-6-azaspiro[3.4]octan-6-yl)-6- meth...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(C)(=O)=O)nc2c(n1)N1CCC2(CC(F)(F)C2)C1
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More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648860
PNG
(6-methyl-N-(1-(methylsulfonyl)piperidin-4-yl)-8- (...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(C)(=O)=O)nc2c(n1)N1CCC2(CC2)C1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648861
PNG
(N-(1-((cyclobutylmethyl)sulfonyl)piperidin-4-yl)- ...)
Show SMILES FC(F)c1cc2cnc(NC3CCN(CC3)S(=O)(=O)CC3CCC3)nc2c(n1)N1CC2(C1)CCNC2
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648862
PNG
(3-cyclopropyl-1-(2-((1- (cyclopropylsulfonyl)piper...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc2c(n1)N1CC(O)(C1)C1CC1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648863
PNG
(8-(3-cyclopropoxyazetidin-1-yl)-N-(1- (cyclopropyl...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc2c(n1)N1CC(C1)OC1CC1
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Ligand-Target Pair
Cyclin-dependent kinase 4/6


(Homo sapiens (Human))
BDBM648864
PNG
(N-(1-(cyclopropylsulfonyl)piperidin-4-yl)-8-(3- (d...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(=O)(=O)C3CC3)nc2c(n1)N1CCC(C1)OC(F)F
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Ligand-Target Pair
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