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Compile Data Set for Download or QSAR

Found 109 hits with Last Name = 'son' and Initial = 'wc'   
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
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM50420244
PNG
(CHEMBL1628111)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(O)(=O)=O)ccc34)[C@@H]1CC[C@@H]2O |r|
Show InChI InChI=1S/C18H24O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-17,19H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,17+,18+/m1/s1
PDB

UniProtKB/SwissProt

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KEGG
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PC sid
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Article
PubMed
380n/an/an/an/an/an/an/an/a



Queen's University

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of LTC4 uptake in membrane vesicle from MRP1-expressing HeLa cells


J Biol Chem 276: 6404-11 (2001)


Article DOI: 10.1074/jbc.m008251200
BindingDB Entry DOI: 10.7270/Q29S1TW9
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM50366524
PNG
(ESTRONE | ESTROPIPATE | Estrone 3-sulfate | Estron...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(O)(=O)=O)ccc34)[C@@H]1CCC2=O
Show InChI InChI=1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,18+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
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DrugBank
MCE
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
450n/an/an/an/an/an/an/an/a



Queen's University

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of LTC4 uptake in membrane vesicle from MRP1-expressing HeLa cells


J Biol Chem 276: 6404-11 (2001)


Article DOI: 10.1074/jbc.m008251200
BindingDB Entry DOI: 10.7270/Q29S1TW9
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1/2


(Homo sapiens (Human))
BDBM50006812
PNG
(7-[3-(4-Acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydro...)
Show SMILES CCCc1c(OCC(O)COc2ccc3c(oc(cc3=O)C(O)=O)c2CCC)ccc(C(C)=O)c1O
Show InChI InChI=1S/C27H30O9/c1-4-6-19-22(10-8-17(15(3)28)25(19)31)34-13-16(29)14-35-23-11-9-18-21(30)12-24(27(32)33)36-26(18)20(23)7-5-2/h8-12,16,29,31H,4-7,13-14H2,1-3H3,(H,32,33)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
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CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 35n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of SRS-A-induced contractions in guinea pig ileum


J Med Chem 30: 173-8 (1987)


BindingDB Entry DOI: 10.7270/Q2D220TJ
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1/2


(Homo sapiens (Human))
BDBM50225202
PNG
(CHEMBL49572)
Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc2ccc(OCCCC(O)=O)cc2c1C(C)=O)C(C)=O
Show InChI InChI=1S/C30H34O8/c1-4-7-24-26(14-12-23(19(2)31)30(24)35)37-16-6-17-38-27-13-10-21-9-11-22(36-15-5-8-28(33)34)18-25(21)29(27)20(3)32/h9-14,18,35H,4-8,15-17H2,1-3H3,(H,33,34)
PDB

UniProtKB/SwissProt

antibodypedia
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PubMed
n/an/a 80n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of SRS-A-induced contractions in guinea pig ileum


J Med Chem 30: 173-8 (1987)


BindingDB Entry DOI: 10.7270/Q2D220TJ
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635856
PNG
(US20230365530, Example 70)
Show SMILES COc1cc2c(NC3CCN(CCO)CC3)nc(nc2cc1C#CCCN1CCCC1)N1CCCC1
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635858
PNG
(US20230365530, Example 72)
Show SMILES CCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CCCC3)c(OC)cc12)N1CC[C@H](F)C1 |r|
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635859
PNG
(US20230365530, Example 73)
Show SMILES COc1cc2c(NC3CC(C)(C)NC(C)(C)C3)nc(nc2cc1C#CCCN1CCCC1)N1CCCC1
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635861
PNG
(US20230365530, Example 75)
Show SMILES COc1cc2c(NC3CCN(CC3)C3CC3)nc(nc2cc1C#CCCN1CCCC1)N1CC[C@H](F)C1 |r|
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635863
PNG
(US20230365530, Example 77)
Show SMILES CCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CCCC3)c(OC)cc12)N1CC[C@@H](F)C1 |r|
PDB

UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635864
PNG
(US20230365530, Example 78)
Show SMILES CCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CC[C@H](F)C3)c(OC)cc12)N1CCCC1 |r|
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635868
PNG
(US20230365530, Example 82)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N(C)CC(=O)OC(C)(C)C
PDB

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635869
PNG
(US20230365530, Example 83)
Show SMILES CCCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CCCC3)c(OC)cc12)N(C)C
PDB

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635870
PNG
(US20230365530, Example 84)
Show SMILES CCCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CCCC3)c(OC)cc12)N1CC[C@@H](F)C1 |r|
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635871
PNG
(US20230365530, Example 85)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1\C=C\CCN1CCCC1)N1CCCC1
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635873
PNG
(US20230365530, Example 87)
Show SMILES COc1cc2c(NC3CCN(CCO)CC3)nc(nc2cc1C#CCCN1CCCC1)N(C)C
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635875
PNG
(US20230365530, Example 89)
Show SMILES COc1cc2c(NC3CCN(CCO)CC3)nc(nc2cc1C#CCCN1CCCC1)N1CC[C@@H](F)C1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1/2


(Homo sapiens (Human))
BDBM50225201
PNG
(CHEMBL51531)
Show SMILES CCCc1c(O)c(ccc1OCCOCCOc1c(CCC)c(OCCCC(O)=O)ccc1C(C)=O)C(C)=O
Show InChI InChI=1S/C30H40O9/c1-5-8-24-26(13-11-22(20(3)31)29(24)35)38-18-16-36-17-19-39-30-23(21(4)32)12-14-27(25(30)9-6-2)37-15-7-10-28(33)34/h11-14,35H,5-10,15-19H2,1-4H3,(H,33,34)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of SRS-A-induced contractions in guinea pig ileum


J Med Chem 30: 173-8 (1987)


BindingDB Entry DOI: 10.7270/Q2D220TJ
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1/2


(Homo sapiens (Human))
BDBM50225299
PNG
(CHEMBL301537)
Show SMILES CCCc1c(O)c(ccc1OCCCCCOc1c(CCC)c(OCC(O)=O)ccc1C(C)=O)C(C)=O
Show InChI InChI=1S/C29H38O8/c1-5-10-23-25(14-12-21(19(3)30)28(23)34)35-16-8-7-9-17-36-29-22(20(4)31)13-15-26(24(29)11-6-2)37-18-27(32)33/h12-15,34H,5-11,16-18H2,1-4H3,(H,32,33)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of SRS-A-induced contractions in guinea pig ileum


J Med Chem 30: 173-8 (1987)


BindingDB Entry DOI: 10.7270/Q2D220TJ
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635768
PNG
(US20230365530, Example 3)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN(C)C)N1CCCCC1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635792
PNG
(US20230365530, Example 6)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN(C)C)N1CCCC1
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635794
PNG
(US20230365530, Example 8)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN(C)C)N1CCCCCC1
PDB

UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635795
PNG
(US20230365530, Example 9)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN(C)C)N1CCC2(CCCC2)C1
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635798
PNG
(US20230365530, Example 12)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCCC1)N1CCCCC1
PDB

UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635800
PNG
(US20230365530, Example 14)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN(C)C)N(C)C
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635802
PNG
(US20230365530, Example 16 | US20230365530, Example...)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CCCCC1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635803
PNG
(US20230365530, Example 17)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN(C)C)N1CCCN(C)CC1
PDB

UniProtKB/SwissProt

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UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635810
PNG
(US20230365530, Example 24)
Show SMILES COc1cc2c(NC3CCN(CC3)C3CC3)nc(nc2cc1C#CCCN(C)C)N1CCCCC1
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635822
PNG
(US20230365530, Example 36)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CCCCCC1
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635828
PNG
(US20230365530, Example 42)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CCCC1
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635829
PNG
(US20230365530, Example 43)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCCC1)N1CCCC1
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635830
PNG
(US20230365530, Example 44)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCCC1)N(C)C
PDB

UniProtKB/SwissProt

GoogleScholar
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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635831
PNG
(US20230365530, Example 45)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCCC1)N1CCCN(C)CC1
PDB

UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635832
PNG
(US20230365530, Example 46)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1C[C@@H]2C[C@@H]2[C@@H]1CO |r|
PDB

UniProtKB/SwissProt

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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635833
PNG
(US20230365530, Example 47)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCCC1)N1C[C@@H]2C[C@@H]2[C@@H]1CO |r|
PDB

UniProtKB/SwissProt

GoogleScholar
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n/an/a<100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635834
PNG
(US20230365530, Example 48)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CCCN(C)CC1
PDB

UniProtKB/SwissProt

GoogleScholar
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UniChem
n/an/a<100n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635835
PNG
(US20230365530, Example 49)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N(C)C
PDB

UniProtKB/SwissProt

GoogleScholar
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PC sid
UniChem
n/an/a<100n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635836
PNG
(US20230365530, Example 50)
Show SMILES CCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN(C)C)c(OC)cc12)N1CCCCC1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635837
PNG
(US20230365530, Example 51)
Show SMILES CCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CCCC3)c(OC)cc12)N1CCCCC1
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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635838
PNG
(US20230365530, Example 52)
Show SMILES COc1cc2c(NCCN(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CCCC1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635839
PNG
(US20230365530, Example 53)
Show SMILES COc1cc2c(NC3CCN(CC3)C3CC3)nc(nc2cc1C#CCCN1CCCC1)N1CCCCC1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635840
PNG
(US20230365530, Example 54)
Show SMILES COc1cc2c(NC3CCN(CC3)C3CC3)nc(nc2cc1C#CCCN1CCCC1)N1CCCC1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635841
PNG
(US20230365530, Example 55)
Show SMILES COc1cc2c(NC3CCN(CC3)C3CC3)nc(nc2cc1C#CCCN1CCCC1)N(C)C
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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635842
PNG
(US20230365530, Example 56)
Show SMILES COc1cc2c(NC3CCN(CC3)C3CC3)nc(nc2cc1C#CCCN1CCCC1)N1CCCN(C)CC1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635843
PNG
(US20230365530, Example 57)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CC[C@H](F)C1 |r|
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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635844
PNG
(US20230365530, Example 58)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CC(F)(F)C1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635845
PNG
(US20230365530, Example 59)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CC(F)C1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635846
PNG
(US20230365530, Example 60)
Show SMILES COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CC[C@@H](F)C1 |r|
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635847
PNG
(US20230365530, Example 61)
Show SMILES COc1cc2c(NCCN(C)C)nc(nc2cc1C#CCCN1CCCC1)N(C)C
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635848
PNG
(US20230365530, Example 62)
Show SMILES COc1cc2c(NCCN(C)C)nc(nc2cc1C#CCCN1CCCC1)N1CCCN(C)CC1
PDB

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Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2


(Homo sapiens (Human))
BDBM635849
PNG
(US20230365530, Example 63)
Show SMILES CCN1CCC(CC1)Nc1nc(nc2cc(C#CCCN3CCCC3)c(OC)cc12)N(C)C
PDB

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Ligand-Target Pair
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