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Compile Data Set for Download or QSAR

Found 151 hits with Last Name = 'okuyama' and Initial = 'k'   
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
Diacylglycerol kinase delta


(Human)
BDBM649820
PNG
(US20240043403, Example 57)
Show SMILES CN1CCN(C[C@@H]1CN)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1Cl |r|
PDB
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n/an/a 0.420n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649819
PNG
(US20240043403, Example 56)
Show SMILES CN1CCN(C[C@@H]1CN)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1Cl |r|
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n/an/a 0.890n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649841
PNG
(US20240043403, Example 78)
Show SMILES CN[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 1.30n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649857
PNG
(US20240043403, Example 94)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1Cl |r|
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n/an/a 1.40n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649881
PNG
(US20240043403, Example 118)
Show SMILES CN(C)[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 1.40n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649849
PNG
(US20240043403, Example 125 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1Cl |r|
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n/an/a 1.80n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649847
PNG
(US20240043403, Example 84)
Show SMILES N[C@H]1CCN2CCN(C[C@H]12)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 2.10n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649856
PNG
(US20240043403, Example 93)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1Cl |r|
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n/an/a 2.80n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649849
PNG
(US20240043403, Example 125 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1Cl |r|
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n/an/a 2.90n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649797
PNG
(US20240043403, Example 34)
Show SMILES NC[C@@H]1CCCN(C1)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 3.10n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649809
PNG
(US20240043403, Example 46)
Show SMILES CN1CCN(C[C@@H]1CN)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1C(F)(F)F |r|
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n/an/a 3.10n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649792
PNG
(US20240043403, Example 122 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 3.20n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649846
PNG
(US20240043403, Example 83)
Show SMILES CN[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 3.5n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649811
PNG
(US20240043403, Example 124 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(C2CCCC2)c1C(F)(F)F |r|
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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649858
PNG
(US20240043403, Example 95)
Show SMILES CNC[C@@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1C(F)(F)F |r|
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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649810
PNG
(US20240043403, Example 123 | US20240043403, Exampl...)
Show SMILES CNC[C@@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 4n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649850
PNG
(US20240043403, Example 87)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1C(F)(F)F |r|
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n/an/a 4.10n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649801
PNG
(US20240043403, Example 38)
Show SMILES CN1CCN(C[C@@H]1CN)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 4.10n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649883
PNG
(US20240043403, Example 120)
Show SMILES CN(C)[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 4.30n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649796
PNG
(US20240043403, Example 33)
Show SMILES NC[C@@H]1CCCN(C1)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1C(F)(F)F |r|
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n/an/a 4.80n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649792
PNG
(US20240043403, Example 122 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 4.90n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649804
PNG
(US20240043403, Example 41)
Show SMILES CN1CCN(C[C@@H]1CN)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(OC2CCCC2)c1C(F)(F)F |r|
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n/an/a 5n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649803
PNG
(US20240043403, Example 40)
Show SMILES CN1CCN(C[C@@H]1CN)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(OC2CCCC2)c1C(F)(F)F |r|
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n/an/a 5.20n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649848
PNG
(US20240043403, Example 85)
Show SMILES CN[C@H]1CCN2CCN(C[C@H]12)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 5.20n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649840
PNG
(US20240043403, Example 77)
Show SMILES N[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 5.60n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649811
PNG
(US20240043403, Example 124 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(C2CCCC2)c1C(F)(F)F |r|
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n/an/a 5.80n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649808
PNG
(US20240043403, Example 126 | US20240043403, Exampl...)
Show SMILES NC[C@]1(F)CCCN(C1)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 6.20n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649810
PNG
(US20240043403, Example 123 | US20240043403, Exampl...)
Show SMILES CNC[C@@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 6.70n/an/an/an/an/an/a


TBA



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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649825
PNG
(US20240043403, Example 62)
Show SMILES Cc1ccccc1Oc1ccc(NC(=O)c2ccn(n2)-c2ccnnc2)c(N2CCC[C@@H](CN)C2)c1C(F)(F)F |r|
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n/an/a 6.90n/an/an/an/an/an/a


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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649869
PNG
(US20240043403, Example 106)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2coc(n2)-c2ccnnc2)cc(F)c(Oc2ccccc2)c1F |r|
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n/an/a 7.5n/an/an/an/an/an/a


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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649861
PNG
(US20240043403, Example 98)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1Cl |r|
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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649839
PNG
(US20240043403, Example 76)
Show SMILES CN[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2)c1C(F)(F)F |r|
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n/an/a 7.60n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649793
PNG
(US20240043403, Example 30)
Show SMILES CNC[C@@H]1CCCN(C1)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2)c1C(F)(F)F |r|
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n/an/a 7.70n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649812
PNG
(US20240043403, Example 49)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(C2CCCC2)c1C(F)(F)F |r|
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n/an/a 7.80n/an/an/an/an/an/a


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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649842
PNG
(US20240043403, Example 79)
Show SMILES NCCOc1cc(ccn1)-c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(OC2CCC2)c1C(F)(F)F
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n/an/a 7.80n/an/an/an/an/an/a


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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649878
PNG
(US20240043403, Example 115)
Show SMILES CN(C)[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2)c1C(F)(F)F |r|
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n/an/a 7.90n/an/an/an/an/an/a


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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649807
PNG
(US20240043403, Example 44)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(OC2CCCC2)c1C(F)(F)F |r|
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n/an/a 8.60n/an/an/an/an/an/a


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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649871
PNG
(US20240043403, Example 108)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)cc(F)c(Oc2ccccc2)c1F |r|
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Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649772
PNG
(US20240043403, Example 9)
Show SMILES NC[C@@H]1CCCN(C1)c1c(NC(=O)c2ccn(CC(F)F)n2)ccc(Oc2ccccc2Cl)c1C(F)(F)F |r|
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n/an/a 9.30n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649792
PNG
(US20240043403, Example 122 | US20240043403, Exampl...)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50120880
PNG
(2-[(2-{2-[2-Amino-3-(3-hydroxy-phenyl)-propionylam...)
Show SMILES C[C@H](N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1cccc(O)c1)C(O)=O
Show InChI InChI=1S/C28H39N7O6/c1-17(27(40)41)35(2)26(39)23(16-18-8-4-3-5-9-18)34-25(38)22(12-7-13-32-28(30)31)33-24(37)21(29)15-19-10-6-11-20(36)14-19/h3-6,8-11,14,17,21-23,36H,7,12-13,15-16,29H2,1-2H3,(H,33,37)(H,34,38)(H,40,41)(H4,30,31,32)/t17-,21-,22-,23-/m0/s1
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n/an/a 10.2n/an/an/an/an/an/a



Daiichi Fine Chemical Co. Ltd.

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards Opioid receptor mu 1 by the displacement of [3H]-DAMGO in mouse spinal cord


J Med Chem 45: 5081-9 (2002)


BindingDB Entry DOI: 10.7270/Q290233R
More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649822
PNG
(US20240043403, Example 59)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(-c2ccccc2F)c1C(F)(F)F |r|
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n/an/a 11n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649818
PNG
(US20240043403, Example 55)
Show SMILES CN1CCN(C[C@H]1CN)c1c(NC(=O)c2coc(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 12n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649817
PNG
(US20240043403, Example 54)
Show SMILES CN1CCN(C[C@H]1CN)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649860
PNG
(US20240043403, Example 97)
Show SMILES CNC[C@H]1CN(CCN1C)c1c(NC(=O)c2cnn(n2)-c2ccnnc2)ccc(Oc2ccccc2Cl)c1C(F)(F)F |r|
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More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649808
PNG
(US20240043403, Example 126 | US20240043403, Exampl...)
Show SMILES NC[C@]1(F)CCCN(C1)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50120878
PNG
(2-[(2-{5-Guanidino-2-[2-guanidino-3-(3-hydroxy-phe...)
Show SMILES [#6]-[#6@H](-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1cccc(-[#8])c1)\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O
Show InChI InChI=1S/C29H41N9O6/c1-17(27(43)44)38(2)26(42)23(15-18-8-4-3-5-9-18)36-24(40)21(12-7-13-34-28(30)31)35-25(41)22(37-29(32)33)16-19-10-6-11-20(39)14-19/h3-6,8-11,14,17,21-23,39H,7,12-13,15-16H2,1-2H3,(H,35,41)(H,36,40)(H,43,44)(H4,30,31,34)(H4,32,33,37)/t17-,21-,22-,23-/m0/s1
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n/an/a 12.9n/an/an/an/an/an/a



Daiichi Fine Chemical Co. Ltd.

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards Opioid receptor mu 1 by the displacement of [3H]-DAMGO in mouse spinal cord


J Med Chem 45: 5081-9 (2002)


BindingDB Entry DOI: 10.7270/Q290233R
More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649827
PNG
(US20240043403, Example 64)
Show SMILES COCCNC[C@@H]1CCCN(C1)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 13n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649884
PNG
(US20240043403, Example 121)
Show SMILES CN(C)[C@@H]1CCN2CCN(C[C@@H]12)c1c(NC(=O)c2ccn(n2)-c2ccnnc2)ccc(OC2CC2)c1C(F)(F)F |r|
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n/an/a 14n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol kinase delta


(Human)
BDBM649764
PNG
(US20240043403, Example 1)
Show SMILES NC[C@@H]1CCCN(C1)c1c(NC(=O)c2ccn(CC(F)F)n2)ccc(Oc2ccccc2F)c1C(F)(F)F |r|
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n/an/a 16n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
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