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Compile Data Set for Download or QSAR

Found 3103 hits with Last Name = 'sutton' and Initial = 'sc'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone acetyltransferase KAT7


(Homo sapiens)
BDBM580680
PNG
(US11492346, Example 20)
Show SMILES COc1cc2CCCCc2cc1S(=O)(=O)Nc1noc2cc(Cn3cccn3)cc(OC)c12
PDB
MMDB

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0n/an/an/an/an/an/an/an/a


TBA

Assay Description
A. Compound preparation 1. Prepare 10 mM stock solutions in 100% DMSO from solid material 2. Serial dilute 10 mM, 1 mM or 0.1 mM compou...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23J3HT5
More data for this
Ligand-Target Pair
Histone acetyltransferase KAT6B


(Homo sapiens)
BDBM580734
PNG
(US11492346, Example 74)
Show SMILES COC(=O)c1c(C)cccc1S(=O)(=O)Nc1noc2cc(Cn3cccn3)cc(OC)c12
PDB
MMDB

Reactome pathway
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0n/an/an/an/an/an/an/an/a


TBA

Assay Description
A. Compound preparation 1. Prepare 10 mM stock solutions in 100% DMSO from solid material 2. Serial dilute 10 mM, 1 mM or 0.1 mM compou...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23J3HT5
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM435691
PNG
(US10570121, Example 197 | US10570121, Example 198)
Show SMILES COc1cc(C)[nH]c(=O)c1CN1CCc2c(C)cc(C(C)C3COC3)c(Cl)c2C1=O
PDB

KEGG

UniProtKB/SwissProt

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0.0100n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM435577
PNG
(US10570121, Example 87)
Show SMILES COc1cc(C)[nH]c(=O)c1CN1CCc2c(Cl)cc(C(C)C3CN(C)C3)c(Cl)c2C1=O
PDB

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0.0100n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM50246932
PNG
(CHEMBL4073864 | US10570121, Example 112)
Show SMILES COC(C1CCN(CC1)C(=O)CO)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl
Show InChI InChI=1S/C26H31Cl2N3O6/c1-14-10-20(36-2)18(25(34)29-14)12-31-9-6-16-19(27)11-17(23(28)22(16)26(31)35)24(37-3)15-4-7-30(8-5-15)21(33)13-32/h10-11,15,24,32H,4-9,12-13H2,1-3H3,(H,29,34)
PDB

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US Patent
0.0200n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498218
PNG
(US11014911, Example 43 | US11718603, Example 43)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2ccnc3ncsc23)n[nH]1 |r|
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TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM50246939
PNG
(CHEMBL4072089 | US10570121, Example 110)
Show SMILES COC(C1CCN(CC1)C(C)=O)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl
Show InChI InChI=1S/C26H31Cl2N3O4/c1-14-11-15(2)29-25(33)20(14)13-31-10-7-18-21(27)12-19(23(28)22(18)26(31)34)24(35-4)17-5-8-30(9-6-17)16(3)32/h11-12,17,24H,5-10,13H2,1-4H3,(H,29,33)
PDB

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US Patent
0.0400n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498218
PNG
(US11014911, Example 43 | US11718603, Example 43)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2ccnc3ncsc23)n[nH]1 |r|
PDB

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0.0400n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM370133
PNG
(US10233188, Example 22 | US10800783, Example 22 | ...)
Show SMILES Cc1cc2cnc(NC3CCN(CC3)S(C)(=O)=O)nc2n(C2CCCC2)c1=O
Show InChI InChI=1S/C19H27N5O3S/c1-13-11-14-12-20-19(21-15-7-9-23(10-8-15)28(2,26)27)22-17(14)24(18(13)25)16-5-3-4-6-16/h11-12,15-16H,3-10H2,1-2H3,(H,20,21,22)
MMDB

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0.0470n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498217
PNG
(US11014911, Example 42 | US11718603, Example 42)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2ccnn2C)n[nH]1 |r|
PDB

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Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498217
PNG
(US11014911, Example 42 | US11718603, Example 42)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2ccnn2C)n[nH]1 |r|
PDB

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0.0500n/an/an/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498324
PNG
(US11014911, Example 149 | US11718603, Example 149)
Show SMILES COc1cc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)N2[C@@H](C)C[C@@H]2C)ccn1 |r|
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TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498324
PNG
(US11014911, Example 149 | US11718603, Example 149)
Show SMILES COc1cc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)N2[C@@H](C)C[C@@H]2C)ccn1 |r|
PDB

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Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM467013
PNG
((-)-6-(2,2-difluoroethyl)-8-[(1R*,2R*)-2-hydroxy-2...)
Show SMILES C[C@@]1(O)CCC[C@H]1n1c2nc(NC3CCN(CC3)S(C)(=O)=O)ncc2cc(CC(F)F)c1=O |r|
Show InChI InChI=1S/C21H29F2N5O4S/c1-21(30)7-3-4-16(21)28-18-14(10-13(19(28)29)11-17(22)23)12-24-20(26-18)25-15-5-8-27(9-6-15)33(2,31)32/h10,12,15-17,30H,3-9,11H2,1-2H3,(H,24,25,26)/t16-,21-/m1/s1
MMDB

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0.0640n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498778
PNG
((1R,3S)-3-(3-{[(3-methyl-1,2- oxazol-5-yl)acetyl]...)
Show SMILES CCC1(C)CCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(C)no2)n[nH]1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498321
PNG
(US11014911, Example 146 | US11718603, Example 146)
Show SMILES COc1cc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)N2CCC2(C)C)ccn1 |r|
PDB

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0.0700n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498778
PNG
((1R,3S)-3-(3-{[(3-methyl-1,2- oxazol-5-yl)acetyl]...)
Show SMILES CCC1(C)CCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(C)no2)n[nH]1 |r|
PDB

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0.0700n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498321
PNG
(US11014911, Example 146 | US11718603, Example 146)
Show SMILES COc1cc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)N2CCC2(C)C)ccn1 |r|
PDB

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0.0700n/an/an/an/an/an/an/an/a


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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498778
PNG
((1R,3S)-3-(3-{[(3-methyl-1,2- oxazol-5-yl)acetyl]...)
Show SMILES CCC1(C)CCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(C)no2)n[nH]1 |r|
PDB

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0.0800n/an/an/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498295
PNG
(US11014911, Example 120 | US11014911, Example 121 ...)
Show SMILES CC1(CCOC1)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(F)cc(F)c2)n[nH]1 |r|
PDB

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0.0800n/an/an/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498316
PNG
(US11014911, Example 141 | US11718603, Example 141)
Show SMILES C[C@H]1CCCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnc3ncnn3c2)n[nH]1 |r|
PDB

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Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498778
PNG
((1R,3S)-3-(3-{[(3-methyl-1,2- oxazol-5-yl)acetyl]...)
Show SMILES CCC1(C)CCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(C)no2)n[nH]1 |r|
PDB

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Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498295
PNG
(US11014911, Example 120 | US11014911, Example 121 ...)
Show SMILES CC1(CCOC1)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(F)cc(F)c2)n[nH]1 |r|
PDB

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Pfizer Inc.

US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498316
PNG
(US11014911, Example 141 | US11718603, Example 141)
Show SMILES C[C@H]1CCCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnc3ncnn3c2)n[nH]1 |r|
PDB

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0.0800n/an/an/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM370147
PNG
(US10233188, Example 36 | US10800783, Example 36 | ...)
Show SMILES C[C@H]1CCC[C@H]1n1c2nc(NC3CCN(CC3)S(C)(=O)=O)ncc2ccc1=O |r|
Show InChI InChI=1S/C19H27N5O3S/c1-13-4-3-5-16(13)24-17(25)7-6-14-12-20-19(22-18(14)24)21-15-8-10-23(11-9-15)28(2,26)27/h6-7,12-13,15-16H,3-5,8-11H2,1-2H3,(H,20,21,22)/t13-,16+/m0/s1
MMDB

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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498295
PNG
(US11014911, Example 120 | US11014911, Example 121 ...)
Show SMILES CC1(CCOC1)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(F)cc(F)c2)n[nH]1 |r|
PDB

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TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498273
PNG
(US11014911, Example 98 | US11014911, Example 99 | ...)
Show SMILES COc1cc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)NC(C)CC(F)F)ccn1 |r|
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498312
PNG
(US11014911, Example 137 | US11718603, Example 137)
Show SMILES CC1(C)CCCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnc3ncnn3c2)n[nH]1 |r|
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498266
PNG
(US11014911, Example 91 | US11718603, Example 91)
Show SMILES C[C@@H](CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2cnnn2C)n[nH]1 |r|
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Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498273
PNG
(US11014911, Example 98 | US11014911, Example 99 | ...)
Show SMILES COc1cc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)NC(C)CC(F)F)ccn1 |r|
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Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498295
PNG
(US11014911, Example 120 | US11014911, Example 121 ...)
Show SMILES CC1(CCOC1)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cc(F)cc(F)c2)n[nH]1 |r|
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Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498312
PNG
(US11014911, Example 137 | US11718603, Example 137)
Show SMILES CC1(C)CCCN1C(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnc3ncnn3c2)n[nH]1 |r|
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Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498266
PNG
(US11014911, Example 91 | US11718603, Example 91)
Show SMILES C[C@@H](CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2cnnn2C)n[nH]1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50609170
PNG
(CHEMBL5266837)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ncc2cc(COC3CC3)c(=O)n(C3CCCC3)c2n1
MMDB

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Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498175
PNG
(US11014911, Example 4 | US11718603, Example 4)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2cnnn2C)n[nH]1 |r|
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Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498230
PNG
(US11014911, Example 55 | US11718603, Example 55)
Show SMILES CC(C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2ccc3n(C)ncc3c2)n[nH]1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498175
PNG
(US11014911, Example 4 | US11718603, Example 4)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2cnnn2C)n[nH]1 |r|
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498267
PNG
(US11014911, Example 92 | US11718603, Example 92)
Show SMILES C[C@@H](CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnn(C)c2)n[nH]1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498258
PNG
(US11014911, Example 83 | US11014911, Example 84 | ...)
Show SMILES CC(CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnco2)n[nH]1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498250
PNG
(US11014911, Example 75 | US11014911, Example 76 | ...)
Show SMILES CC(CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2ccc(C)nc2)n[nH]1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498319
PNG
(US11014911, Example 144 | US11718603, Example 144)
Show SMILES COc1ccc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)N2CCC2(C)C)cn1 |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q22F7SJ2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498319
PNG
(US11014911, Example 144 | US11718603, Example 144)
Show SMILES COc1ccc(CC(=O)Nc2cc([nH]n2)[C@H]2CC[C@H](C2)OC(=O)N2CCC2(C)C)cn1 |r|
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US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498228
PNG
(US11014911, Example 53 | US11718603, Example 53)
Show SMILES CC[C@H](C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)c2ccnn2CCO)n[nH]1 |r|
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US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498230
PNG
(US11014911, Example 55 | US11718603, Example 55)
Show SMILES CC(C)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2ccc3n(C)ncc3c2)n[nH]1 |r|
PDB

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US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498250
PNG
(US11014911, Example 75 | US11014911, Example 76 | ...)
Show SMILES CC(CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2ccc(C)nc2)n[nH]1 |r|
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US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498258
PNG
(US11014911, Example 83 | US11014911, Example 84 | ...)
Show SMILES CC(CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnco2)n[nH]1 |r|
PDB

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US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))
BDBM498267
PNG
(US11014911, Example 92 | US11718603, Example 92)
Show SMILES C[C@@H](CC(F)(F)F)NC(=O)O[C@@H]1CC[C@@H](C1)c1cc(NC(=O)Cc2cnn(C)c2)n[nH]1 |r|
PDB

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US Patent


Assay Description
The purpose of CDK2/Cyclin E1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) of small molecule inhibitors by using a fluores...


US Patent US11014911 (2021)


BindingDB Entry DOI: 10.7270/Q23N26H2
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM435609
PNG
(US10570121, Example 118 | US10570121, Example 119)
Show SMILES COC(C1CCN(CC1)C=O)c1cc(Cl)c2CCN(Cc3c(OC)cc(C)[nH]c3=O)C(=O)c2c1Cl
PDB

KEGG

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Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM50246940
PNG
(CHEMBL4071056 | US10570121, Example 137)
Show SMILES COC(C1CCN(C)CC1)c1cc(Cl)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl
Show InChI InChI=1S/C25H31Cl2N3O3/c1-14-11-15(2)28-24(31)19(14)13-30-10-7-17-20(26)12-18(22(27)21(17)25(30)32)23(33-4)16-5-8-29(3)9-6-16/h11-12,16,23H,5-10,13H2,1-4H3,(H,28,31)
PDB

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US Patent
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Pfizer Inc.

US Patent


Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM435640
PNG
(US10570121, Example 146 | US10570121, Example 147)
Show SMILES COC(C1CCN(C)CC1)c1cc(Br)c2CCN(Cc3c(C)cc(C)[nH]c3=O)C(=O)c2c1Cl
PDB

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Assay Description
A. Compound preparation1. Prepare 10 mM stock solutions in 100% DMSO from solid material2. Serial dilute 10 mM compound stocks either 2 or 3-fold in ...


US Patent US10570121 (2020)


BindingDB Entry DOI: 10.7270/Q28W3GQD
More data for this
Ligand-Target Pair
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