BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 39 hits with Last Name = 'budesinsky' and Initial = 'm'   
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
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50304738
PNG
(2-(3-((S)-1-carboxy-3-methylbutyl)ureido)pentanedi...)
Show SMILES CC(C)C[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H20N2O7/c1-6(2)5-8(11(19)20)14-12(21)13-7(10(17)18)3-4-9(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)(H2,13,14,21)/t7-,8-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/a 0.5n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503760
PNG
(CHEMBL4442450)
Show SMILES CC(C)C[C@H](NC(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H19NO8/c1-6(2)5-7(10(16)17)13-12(20)21-8(11(18)19)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 0.650n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503756
PNG
(CHEMBL4473741)
Show SMILES CC(C)C[C@@H](NC(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H19NO8/c1-6(2)5-7(10(16)17)13-12(20)21-8(11(18)19)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 8.90n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503754
PNG
(CHEMBL4458733)
Show SMILES CC(C)C[C@@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H20N2O7/c1-6(2)5-8(11(19)20)14-12(21)13-7(10(17)18)3-4-9(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)(H2,13,14,21)/t7-,8+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503757
PNG
(CHEMBL4541841)
Show SMILES CC(C)C[C@H](OC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H19NO8/c1-6(2)5-8(11(18)19)21-12(20)13-7(10(16)17)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 17n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Betaine--homocysteine S-methyltransferase 1


(Homo sapiens (Human))
BDBM50189917
PNG
((R,S)-5-(3-amino-3-carboxy-propylsulfanyl)-pentano...)
Show SMILES NC(CCSCCCCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H17NO4S/c10-7(9(13)14)4-6-15-5-2-1-3-8(11)12/h7H,1-6,10H2,(H,11,12)(H,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/a 87n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of human BHMT


J Med Chem 49: 3982-9 (2006)


Article DOI: 10.1021/jm050885v
BindingDB Entry DOI: 10.7270/Q2S75FXJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498433
PNG
(CHEMBL3593892)
Show SMILES c1ccncc1.[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OS(O)(=O)=O)[C@H](C)CC |r|
Show InChI InChI=1S/C23H40O4S.C5H5N/c1-5-15(2)19-8-9-20-18-7-6-16-14-17(27-28(24,25)26)10-12-22(16,3)21(18)11-13-23(19,20)4;1-2-4-6-5-3-1/h15-21H,5-14H2,1-4H3,(H,24,25,26);1-5H/t15-,16-,17-,18+,19-,20+,21+,22+,23-;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Betaine--homocysteine S-methyltransferase 1


(Homo sapiens (Human))
BDBM50189914
PNG
((R,S)-2-amino-4-(2-carboxymethylsulfanyl-ethylsulf...)
Show SMILES NC(CCSCCSCC(O)=O)C(O)=O
Show InChI InChI=1S/C8H15NO4S2/c9-6(8(12)13)1-2-14-3-4-15-5-7(10)11/h6H,1-5,9H2,(H,10,11)(H,12,13)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 96n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of human BHMT


J Med Chem 49: 3982-9 (2006)


Article DOI: 10.1021/jm050885v
BindingDB Entry DOI: 10.7270/Q2S75FXJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498431
PNG
(CHEMBL3594108)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](C(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C22H38O4S.C5H5N/c1-14(2)18-7-8-19-17-6-5-15-13-16(26-27(23,24)25)9-11-21(15,3)20(17)10-12-22(18,19)4;1-2-4-6-5-3-1/h14-20H,5-13H2,1-4H3,(H,23,24,25);1-5H/t15-,16-,17+,18-,19+,20+,21+,22-;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 170n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Betaine--homocysteine S-methyltransferase 1


(Homo sapiens (Human))
BDBM50189912
PNG
((R,S)-6-(3-amino-3-carboxy-propylsulfanyl)-hexanoi...)
Show SMILES NC(CCSCCCCCC(O)=O)C(O)=O
Show InChI InChI=1S/C10H19NO4S/c11-8(10(14)15)5-7-16-6-3-1-2-4-9(12)13/h8H,1-7,11H2,(H,12,13)(H,14,15)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of human BHMT


J Med Chem 49: 3982-9 (2006)


Article DOI: 10.1021/jm050885v
BindingDB Entry DOI: 10.7270/Q2S75FXJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2C


(Homo sapiens (Human))
BDBM50498430
PNG
(CHEMBL3594112)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H34O4S.C5H5N/c1-13-4-7-17-16-6-5-14-12-15(24-25(21,22)23)8-10-20(14,3)18(16)9-11-19(13,17)2;1-2-4-6-5-3-1/h13-18H,4-12H2,1-3H3,(H,21,22,23);1-5H/t13-,14+,15+,16-,17-,18-,19+,20-;/m0./s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2C receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498443
PNG
(CHEMBL3594106)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](CC)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C21H36O4S.C5H5N/c1-4-14-6-8-18-17-7-5-15-13-16(25-26(22,23)24)9-11-21(15,3)19(17)10-12-20(14,18)2;1-2-4-6-5-3-1/h14-19H,4-13H2,1-3H3,(H,22,23,24);1-5H/t14-,15+,16+,17-,18-,19-,20+,21-;/m0./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498440
PNG
(CHEMBL3594107)
Show SMILES c1ccncc1.[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OS(O)(=O)=O)C(C)=C |r|
Show InChI InChI=1S/C22H36O4S.C5H5N/c1-14(2)18-7-8-19-17-6-5-15-13-16(26-27(23,24)25)9-11-21(15,3)20(17)10-12-22(18,19)4;1-2-4-6-5-3-1/h15-20H,1,5-13H2,2-4H3,(H,23,24,25);1-5H/t15-,16-,17+,18-,19+,20+,21+,22-;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2D


(Homo sapiens (Human))
BDBM50498430
PNG
(CHEMBL3594112)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H34O4S.C5H5N/c1-13-4-7-17-16-6-5-14-12-15(24-25(21,22)23)8-10-20(14,3)18(16)9-11-19(13,17)2;1-2-4-6-5-3-1/h13-18H,4-12H2,1-3H3,(H,21,22,23);1-5H/t13-,14+,15+,16-,17-,18-,19+,20-;/m0./s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2D receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503758
PNG
(CHEMBL4587808)
Show SMILES CC(C)C[C@@H](OC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H19NO8/c1-6(2)5-8(11(18)19)21-12(20)13-7(10(16)17)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 531n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498430
PNG
(CHEMBL3594112)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H34O4S.C5H5N/c1-13-4-7-17-16-6-5-14-12-15(24-25(21,22)23)8-10-20(14,3)18(16)9-11-19(13,17)2;1-2-4-6-5-3-1/h13-18H,4-12H2,1-3H3,(H,21,22,23);1-5H/t13-,14+,15+,16-,17-,18-,19+,20-;/m0./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498445
PNG
(CHEMBL3594109)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](I)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C19H31IO4S.C5H5N/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18;1-2-4-6-5-3-1/h12-17H,3-11H2,1-2H3,(H,21,22,23);1-5H/t12-,13-,14+,15+,16+,17+,18+,19+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2A


(Homo sapiens (Human))
BDBM50498430
PNG
(CHEMBL3594112)
Show SMILES c1ccncc1.[H][C@@]12CC[C@H](C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H34O4S.C5H5N/c1-13-4-7-17-16-6-5-14-12-15(24-25(21,22)23)8-10-20(14,3)18(16)9-11-19(13,17)2;1-2-4-6-5-3-1/h13-18H,4-12H2,1-3H3,(H,21,22,23);1-5H/t13-,14+,15+,16-,17-,18-,19+,20-;/m0./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2A receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503755
PNG
(CHEMBL4462654)
Show SMILES CC(C)C[C@H](NC(=O)O[C@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H19NO8/c1-6(2)5-7(10(16)17)13-12(20)21-8(11(18)19)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 630n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498441
PNG
(CHEMBL3594117)
Show SMILES c1ccncc1.[H][C@]12CC[C@@]3([H])[C@@]([H])(CC[C@]4([H])C[C@@H](CC[C@]34C)OS(O)(=O)=O)[C@]1([H])CC[C@@H]2C |r|
Show InChI InChI=1S/C19H32O4S.C5H5N/c1-12-3-5-16-15(12)7-8-18-17(16)6-4-13-11-14(23-24(20,21)22)9-10-19(13,18)2;1-2-4-6-5-3-1/h12-18H,3-11H2,1-2H3,(H,20,21,22);1-5H/t12-,13+,14+,15+,16+,17-,18-,19-;/m0./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 700n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498432
PNG
(CHEMBL3594113)
Show SMILES c1ccncc1.[H][C@@]12CC\C(=C\C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C21H34O4S.C5H5N/c1-4-14-6-8-18-17-7-5-15-13-16(25-26(22,23)24)9-11-21(15,3)19(17)10-12-20(14,18)2;1-2-4-6-5-3-1/h4,15-19H,5-13H2,1-3H3,(H,22,23,24);1-5H/b14-4-;/t15-,16-,17+,18+,19+,20-,21+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 800n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498436
PNG
(CHEMBL3594116)
Show SMILES c1ccncc1.[H][C@@]12CC[C@@]3([H])[C@@]([H])(CC[C@]4([H])C[C@@H](CC[C@]34C)OS(O)(=O)=O)[C@]1([H])CC[C@H]2C |r|
Show InChI InChI=1S/C19H32O4S.C5H5N/c1-12-3-5-16-15(12)7-8-18-17(16)6-4-13-11-14(23-24(20,21)22)9-10-19(13,18)2;1-2-4-6-5-3-1/h12-18H,3-11H2,1-2H3,(H,20,21,22);1-5H/t12-,13-,14-,15+,16-,17+,18+,19+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498437
PNG
(CHEMBL3594115)
Show SMILES c1ccncc1.[H][C@]12CC[C@@]3([H])[C@]4([H])CCCC[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC[C@H](C2)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H34O4S.C5H5N/c1-19-10-4-3-5-17(19)16-7-6-14-13-15(24-25(21,22)23)8-12-20(14,2)18(16)9-11-19;1-2-4-6-5-3-1/h14-18H,3-13H2,1-2H3,(H,21,22,23);1-5H/t14-,15-,16+,17+,18+,19+,20+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498444
PNG
(CHEMBL3594110)
Show SMILES c1ccncc1.[H][C@@]12CCC[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C19H32O4S.C5H5N/c1-18-9-3-4-16(18)15-6-5-13-12-14(23-24(20,21)22)7-11-19(13,2)17(15)8-10-18;1-2-4-6-5-3-1/h13-17H,3-12H2,1-2H3,(H,20,21,22);1-5H/t13-,14-,15+,16+,17+,18+,19+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498438
PNG
(CHEMBL3594111)
Show SMILES c1ccncc1.[H][C@@]12CCC(=C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H32O4S.C5H5N/c1-13-4-7-17-16-6-5-14-12-15(24-25(21,22)23)8-10-20(14,3)18(16)9-11-19(13,17)2;1-2-4-6-5-3-1/h14-18H,1,4-12H2,2-3H3,(H,21,22,23);1-5H/t14-,15-,16+,17+,18+,19-,20+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498435
PNG
(CHEMBL3594118)
Show SMILES c1ccncc1.[H][C@@]12CC(=C)C[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C20H32O4S.C5H5N/c1-13-10-18-16-5-4-14-11-15(24-25(21,22)23)6-9-20(14,3)17(16)7-8-19(18,2)12-13;1-2-4-6-5-3-1/h14-18H,1,4-12H2,2-3H3,(H,21,22,23);1-5H/t14-,15-,16-,17+,18+,19-,20+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.20E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Betaine--homocysteine S-methyltransferase 1


(Homo sapiens (Human))
BDBM50189915
PNG
((R,S)-5-(3-amino-3-carboxy-propylsulfinyl)-pentano...)
Show SMILES NC(CCS(=O)CCCCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H17NO5S/c10-7(9(13)14)4-6-16(15)5-2-1-3-8(11)12/h7H,1-6,10H2,(H,11,12)(H,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of human BHMT


J Med Chem 49: 3982-9 (2006)


Article DOI: 10.1021/jm050885v
BindingDB Entry DOI: 10.7270/Q2S75FXJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498434
PNG
(CHEMBL3594120)
Show SMILES c1ccncc1.[H][C@@]12CCC[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12[H])OS(O)(=O)=O |r|
Show InChI InChI=1S/C18H30O4S.C5H5N/c1-18-9-2-3-17(18)16-6-4-12-11-13(22-23(19,20)21)5-7-14(12)15(16)8-10-18;1-2-4-6-5-3-1/h12-17H,2-11H2,1H3,(H,19,20,21);1-5H/t12-,13-,14+,15-,16-,17+,18+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.40E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Betaine--homocysteine S-methyltransferase 1


(Homo sapiens (Human))
BDBM50189916
PNG
((R,S)-2-amino-4-(4-phosphono-butylsulfanyl)-butyri...)
Show SMILES NC(CCSCCCCP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C8H18NO5PS/c9-7(8(10)11)3-6-16-5-2-1-4-15(12,13)14/h7H,1-6,9H2,(H,10,11)(H2,12,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.70E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of human BHMT


J Med Chem 49: 3982-9 (2006)


Article DOI: 10.1021/jm050885v
BindingDB Entry DOI: 10.7270/Q2S75FXJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498442
PNG
(CHEMBL3594114)
Show SMILES c1ccncc1.[H][C@@]12CCC(F)(F)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C19H30F2O4S.C5H5N/c1-17-8-5-13(25-26(22,23)24)11-12(17)3-4-14-15(17)6-9-18(2)16(14)7-10-19(18,20)21;1-2-4-6-5-3-1/h12-16H,3-11H2,1-2H3,(H,22,23,24);1-5H/t12-,13-,14-,15+,16+,17+,18+;/m1./s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
Betaine--homocysteine S-methyltransferase 1


(Homo sapiens (Human))
BDBM50189913
PNG
((R,S)-4-(3-amino-3-carboxy-propylsulfanyl)-benzoic...)
Show SMILES NC(CCSc1ccc(cc1)C(O)=O)C(O)=O
Show InChI InChI=1S/C11H13NO4S/c12-9(11(15)16)5-6-17-8-3-1-7(2-4-8)10(13)14/h1-4,9H,5-6,12H2,(H,13,14)(H,15,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of human BHMT


J Med Chem 49: 3982-9 (2006)


Article DOI: 10.1021/jm050885v
BindingDB Entry DOI: 10.7270/Q2S75FXJ
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50503759
PNG
(CHEMBL4513258)
Show SMILES CC(C)C[C@@H](NC(=O)O[C@H](CCC(O)=O)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C12H19NO8/c1-6(2)5-7(10(16)17)13-12(20)21-8(11(18)19)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.53E+3n/an/an/an/an/an/a



Institute of Biotechnology of the Czech Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...


Bioorg Med Chem 27: 255-264 (2019)


Article DOI: 10.1016/j.bmc.2018.11.022
BindingDB Entry DOI: 10.7270/Q2F47SC4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50498439
PNG
(CHEMBL1179566)
Show SMILES [H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
Show InChI InChI=1S/C21H34O5S/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19H,4-12H2,1-3H3,(H,23,24,25)/t14-,15-,16+,17-,18+,19+,20+,21-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
MCE
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.34E+4n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic v.v.i.

Curated by ChEMBL


Assay Description
Inhibition of recombinant GluN1/GluN2B receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of glutamate-evoked current by whol...


J Med Chem 58: 5950-66 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00570
BindingDB Entry DOI: 10.7270/Q2959MKM
More data for this
Ligand-Target Pair
2-5A-dependent ribonuclease


(Mus musculus)
BDBM50189862
PNG
(CHEMBL414569 | {[(2R,3R,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)O[C@H]2[C@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@@H](COP(O)(=O)O[C@@H]4[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]4n4cnc5c(N)ncnc45)O[C@H]3n3cnc4c(N)ncnc34)O[C@H]2n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1OP(O)(O)=O
Show InChI InChI=1S/C40H51N20O28P5/c41-29-17-33(49-5-45-29)57(9-53-17)37-25(85-90(68,69)70)21(61)14(82-37)2-78-91(71,72)87-27-23(63)16(84-39(27)59-11-55-19-31(43)47-7-51-35(19)59)4-80-93(75,76)88-28-24(64)15(83-40(28)60-12-56-20-32(44)48-8-52-36(20)60)3-79-92(73,74)86-26-22(62)13(1-77-89(65,66)67)81-38(26)58-10-54-18-30(42)46-6-50-34(18)58/h5-16,21-28,37-40,61-64H,1-4H2,(H,71,72)(H,73,74)(H,75,76)(H2,41,45,49)(H2,42,46,50)(H2,43,47,51)(H2,44,48,52)(H2,65,66,67)(H2,68,69,70)/t13-,14-,15-,16-,21-,22-,23-,24-,25-,26-,27+,28-,37-,38-,39-,40-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.60n/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Activation of mouse RNase L assessed as ability to cleave 5'-[32P]r(C11U2C7)


J Med Chem 49: 3955-62 (2006)


Article DOI: 10.1021/jm050401v
BindingDB Entry DOI: 10.7270/Q2X066N8
More data for this
Ligand-Target Pair
2-5A-dependent ribonuclease


(Mus musculus)
BDBM50189863
PNG
(CHEMBL439290 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)O[C@@H]2[C@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@@H](COP(O)(=O)O[C@@H]4[C@@H](O)[C@@H](COP(O)(O)=O)O[C@H]4n4cnc5c(N)ncnc45)O[C@H]3n3cnc4c(N)ncnc34)O[C@H]2n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1OP(O)(O)=O
Show InChI InChI=1S/C40H51N20O28P5/c41-29-17-33(49-5-45-29)57(9-53-17)37-25(85-90(68,69)70)21(61)14(82-37)2-78-91(71,72)87-27-23(63)16(84-39(27)59-11-55-19-31(43)47-7-51-35(19)59)4-80-93(75,76)88-28-24(64)15(83-40(28)60-12-56-20-32(44)48-8-52-36(20)60)3-79-92(73,74)86-26-22(62)13(1-77-89(65,66)67)81-38(26)58-10-54-18-30(42)46-6-50-34(18)58/h5-16,21-28,37-40,61-64H,1-4H2,(H,71,72)(H,73,74)(H,75,76)(H2,41,45,49)(H2,42,46,50)(H2,43,47,51)(H2,44,48,52)(H2,65,66,67)(H2,68,69,70)/t13-,14-,15-,16-,21-,22+,23-,24-,25-,26-,27-,28-,37-,38-,39-,40-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 396n/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Activation of mouse RNase L assessed as ability to cleave 5'-[32P]r(C11U2C7)


J Med Chem 49: 3955-62 (2006)


Article DOI: 10.1021/jm050401v
BindingDB Entry DOI: 10.7270/Q2X066N8
More data for this
Ligand-Target Pair
2-5A-dependent ribonuclease


(Mus musculus)
BDBM50189861
PNG
(CHEMBL424746 | {[(2R,3R,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)O[C@@H]2[C@@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@@H](COP(O)(=O)O[C@@H]4[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]4n4cnc5c(N)ncnc45)O[C@H]3n3cnc4c(N)ncnc34)O[C@H]2n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1OP(O)(O)=O
Show InChI InChI=1S/C40H51N20O28P5/c41-29-17-33(49-5-45-29)57(9-53-17)37-25(85-90(68,69)70)21(61)14(82-37)2-78-91(71,72)87-27-23(63)16(84-39(27)59-11-55-19-31(43)47-7-51-35(19)59)4-80-93(75,76)88-28-24(64)15(83-40(28)60-12-56-20-32(44)48-8-52-36(20)60)3-79-92(73,74)86-26-22(62)13(1-77-89(65,66)67)81-38(26)58-10-54-18-30(42)46-6-50-34(18)58/h5-16,21-28,37-40,61-64H,1-4H2,(H,71,72)(H,73,74)(H,75,76)(H2,41,45,49)(H2,42,46,50)(H2,43,47,51)(H2,44,48,52)(H2,65,66,67)(H2,68,69,70)/t13-,14-,15-,16-,21-,22-,23+,24-,25-,26-,27-,28-,37-,38-,39-,40-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.30n/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Activation of mouse RNase L assessed as ability to cleave 5'-[32P]r(C11U2C7)


J Med Chem 49: 3955-62 (2006)


Article DOI: 10.1021/jm050401v
BindingDB Entry DOI: 10.7270/Q2X066N8
More data for this
Ligand-Target Pair
2-5A-dependent ribonuclease


(Mus musculus)
BDBM50189860
PNG
(CHEMBL261902 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)O[C@@H]2[C@@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@@H](COP(O)(=O)O[C@@H]4[C@@H](O)[C@@H](COP(O)(O)=O)O[C@H]4n4cnc5c(N)ncnc45)O[C@H]3n3cnc4c(N)ncnc34)O[C@H]2n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1OP(O)(O)=O
Show InChI InChI=1S/C40H51N20O28P5/c41-29-17-33(49-5-45-29)57(9-53-17)37-25(85-90(68,69)70)21(61)14(82-37)2-78-91(71,72)87-27-23(63)16(84-39(27)59-11-55-19-31(43)47-7-51-35(19)59)4-80-93(75,76)88-28-24(64)15(83-40(28)60-12-56-20-32(44)48-8-52-36(20)60)3-79-92(73,74)86-26-22(62)13(1-77-89(65,66)67)81-38(26)58-10-54-18-30(42)46-6-50-34(18)58/h5-16,21-28,37-40,61-64H,1-4H2,(H,71,72)(H,73,74)(H,75,76)(H2,41,45,49)(H2,42,46,50)(H2,43,47,51)(H2,44,48,52)(H2,65,66,67)(H2,68,69,70)/t13-,14-,15-,16-,21-,22+,23+,24-,25-,26-,27-,28-,37-,38-,39-,40-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 323n/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Activation of mouse RNase L assessed as ability to cleave 5'-[32P]r(C11U2C7)


J Med Chem 49: 3955-62 (2006)


Article DOI: 10.1021/jm050401v
BindingDB Entry DOI: 10.7270/Q2X066N8
More data for this
Ligand-Target Pair
2-5A-dependent ribonuclease


(Mus musculus)
BDBM50189859
PNG
(CHEMBL427600 | {[(2R,3R,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)O[C@@H]2[C@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@@H](COP(O)(=O)O[C@@H]4[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]4n4cnc5c(N)ncnc45)O[C@H]3n3cnc4c(N)ncnc34)O[C@H]2n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1OP(O)(O)=O
Show InChI InChI=1S/C40H51N20O28P5/c41-29-17-33(49-5-45-29)57(9-53-17)37-25(85-90(68,69)70)21(61)14(82-37)2-78-91(71,72)87-27-23(63)16(84-39(27)59-11-55-19-31(43)47-7-51-35(19)59)4-80-93(75,76)88-28-24(64)15(83-40(28)60-12-56-20-32(44)48-8-52-36(20)60)3-79-92(73,74)86-26-22(62)13(1-77-89(65,66)67)81-38(26)58-10-54-18-30(42)46-6-50-34(18)58/h5-16,21-28,37-40,61-64H,1-4H2,(H,71,72)(H,73,74)(H,75,76)(H2,41,45,49)(H2,42,46,50)(H2,43,47,51)(H2,44,48,52)(H2,65,66,67)(H2,68,69,70)/t13-,14-,15-,16-,21-,22-,23-,24-,25-,26-,27-,28-,37-,38-,39-,40-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 0.900n/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Activation of mouse RNase L assessed as ability to cleave 5'-[32P]r(C11U2C7)


J Med Chem 49: 3955-62 (2006)


Article DOI: 10.1021/jm050401v
BindingDB Entry DOI: 10.7270/Q2X066N8
More data for this
Ligand-Target Pair
2-5A-dependent ribonuclease


(Mus musculus)
BDBM50189858
PNG
(CHEMBL434553 | {[(2R,3R,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)O[C@@H]2[C@@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@@H](O)[C@@H](COP(O)(=O)O[C@@H]4[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]4n4cnc5c(N)ncnc45)O[C@H]3n3cnc4c(N)ncnc34)O[C@H]2n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1OP(O)(O)=O
Show InChI InChI=1S/C40H51N20O28P5/c41-29-17-33(49-5-45-29)57(9-53-17)37-25(85-90(68,69)70)21(61)14(82-37)2-78-91(71,72)87-27-23(63)16(84-39(27)59-11-55-19-31(43)47-7-51-35(19)59)4-80-93(75,76)88-28-24(64)15(83-40(28)60-12-56-20-32(44)48-8-52-36(20)60)3-79-92(73,74)86-26-22(62)13(1-77-89(65,66)67)81-38(26)58-10-54-18-30(42)46-6-50-34(18)58/h5-16,21-28,37-40,61-64H,1-4H2,(H,71,72)(H,73,74)(H,75,76)(H2,41,45,49)(H2,42,46,50)(H2,43,47,51)(H2,44,48,52)(H2,65,66,67)(H2,68,69,70)/t13-,14-,15-,16-,21-,22-,23+,24+,25-,26-,27-,28-,37-,38-,39-,40-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 393n/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Activation of mouse RNase L assessed as ability to cleave 5'-[32P]r(C11U2C7)


J Med Chem 49: 3955-62 (2006)


Article DOI: 10.1021/jm050401v
BindingDB Entry DOI: 10.7270/Q2X066N8
More data for this
Ligand-Target Pair