CodeHZR
NameJNJ-40411813
SynonymsJNJ-40411813
Identifier
FormulaC20 H25 Cl N2 O
Molecular Weight344.878
SMILES
PubChem25195461
Formal Charge0
Total Atoms49
Total Chiral Atoms0
Total Bonds51
Total Aromatic Bonds6
Networks6
missing image

This ligand is also present in the following 6 networks:

Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7E9G C Aminoacid Metabotropic Glutamate mGlu2; mGlu2 Homo Sapiens Eglumetad JNJ-40411813 Gi1/Beta1/Gamma2 3.5 2021-06-23 10.1038/s41586-021-03495-2

A 2D representation of the interactions of HZR in 7E9G
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:F623 R:R:M619 9.95 6 No Yes 8 7 2 2
R:R:L639 R:R:M619 2.83 6 Yes Yes 8 7 1 2
R:R:F623 R:R:L639 2.44 6 No Yes 8 8 2 1
R:R:F623 R:R:M794 4.98 6 No No 8 9 2 2
R:R:G640 R:R:L639 3.42 0 No Yes 6 8 2 1
R:R:F643 R:R:L639 4.87 6 Yes Yes 8 8 1 1
R:R:L639 W:W:?902 2.12 6 Yes Yes 8 0 1 0
R:R:F643 R:R:Y647 7.22 6 Yes Yes 8 6 1 1
R:R:F643 R:R:N735 4.83 6 Yes No 8 7 1 1
R:R:F643 R:R:W773 7.02 6 Yes Yes 8 9 1 1
R:R:F643 W:W:?902 15.83 6 Yes Yes 8 0 1 0
R:R:N735 R:R:Y647 9.3 6 No Yes 7 6 1 1
R:R:L738 R:R:Y647 2.34 0 No Yes 9 6 2 1
R:R:I739 R:R:Y647 7.25 6 No Yes 8 6 2 1
R:R:W773 R:R:Y647 20.26 6 Yes Yes 9 6 1 1
R:R:Y647 W:W:?902 8.96 6 Yes Yes 6 0 1 0
R:R:M728 R:R:N722 4.21 6 No No 7 6 1 2
R:R:D725 R:R:M728 4.16 6 No No 4 7 1 1
R:R:D725 R:R:L729 19 6 No No 4 5 1 2
R:R:D725 W:W:?902 12.45 6 No Yes 4 0 1 0
R:R:M728 W:W:?902 11.89 6 No Yes 7 0 1 0
R:R:L732 R:R:L777 4.15 6 No No 8 7 1 1
R:R:L732 W:W:?902 13.75 6 No Yes 8 0 1 0
R:R:N735 W:W:?902 12.59 6 No Yes 7 0 1 0
R:R:I739 R:R:W773 2.35 6 No Yes 8 9 2 1
R:R:T769 R:R:W773 4.85 0 No Yes 8 9 2 1
R:R:S801 R:R:W773 8.65 0 No Yes 9 9 2 1
R:R:W773 W:W:?902 9.58 6 Yes Yes 9 0 1 0
R:R:L777 R:R:P778 3.28 6 No No 7 8 1 2
R:R:L777 W:W:?902 3.17 6 No Yes 7 0 1 0
R:R:F780 R:R:Q790 14.05 6 No Yes 8 7 1 1
R:R:F780 R:R:M794 7.46 6 No No 8 9 1 2
R:R:F780 W:W:?902 14.89 6 No Yes 8 0 1 0
R:R:Q790 R:R:S784 8.66 6 Yes No 7 6 1 1
R:R:S784 W:W:?902 3.44 6 No Yes 6 0 1 0
R:R:Q790 R:R:Y787 34.95 6 Yes No 7 5 1 2
R:R:Q790 R:R:T793 2.83 6 Yes No 7 8 1 2
R:R:Q790 W:W:?902 2.03 6 Yes Yes 7 0 1 0
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub5.00
Average Interaction Strength9.22
Average Nodes In Shell26.00
Average Hubs In Shell7.00
Average Links In Shell38.00
Average Links Mediated by Hubs In Shell31.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8JD3 C Aminoacid Metabotropic Glutamate mGlu2; mGlu3 Homo Sapiens Glutamate HZR; PEF Gi1/Beta1/Gamma2 3.3 2023-06-21 10.1038/s41422-023-00830-2

A 2D representation of the interactions of HZR in 8JD3
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:F623 R:R:M619 4.98 6 Yes Yes 8 7 2 2
R:R:L639 R:R:M619 2.83 6 Yes Yes 8 7 1 2
R:R:F623 R:R:L639 4.87 6 Yes Yes 8 8 2 1
R:R:F623 R:R:M794 4.98 6 Yes Yes 8 9 2 2
R:R:L639 R:R:M728 5.65 6 Yes No 8 7 1 1
R:R:L639 W:W:?1 6.35 6 Yes Yes 8 0 1 0
R:R:G640 R:R:Q690 3.29 6 No Yes 6 9 1 2
R:R:G640 R:R:S731 1.86 6 No No 6 7 1 1
R:R:G640 W:W:?1 2.61 6 No Yes 6 0 1 0
R:R:F643 R:R:Y647 7.22 6 Yes Yes 8 6 1 1
R:R:F643 R:R:N735 2.42 6 Yes Yes 8 7 1 1
R:R:F643 R:R:W773 7.02 6 Yes Yes 8 9 1 1
R:R:F643 R:R:V798 3.93 6 Yes No 8 8 1 2
R:R:F643 W:W:?1 12.1 6 Yes Yes 8 0 1 0
R:R:Q690 R:R:S644 5.78 6 Yes No 9 8 2 2
R:R:S644 R:R:Y734 2.54 6 No Yes 8 8 2 2
R:R:N735 R:R:S644 2.98 6 Yes No 7 8 1 2
R:R:N735 R:R:Y647 6.98 6 Yes Yes 7 6 1 1
R:R:L738 R:R:Y647 2.34 0 No Yes 9 6 2 1
R:R:I739 R:R:Y647 13.3 6 No Yes 8 6 1 1
R:R:T769 R:R:Y647 3.75 0 No Yes 8 6 2 1
R:R:Y647 W:W:?1 8.96 6 Yes Yes 6 0 1 0
R:R:Q690 R:R:S731 8.66 6 Yes No 9 7 2 1
R:R:Q690 R:R:Y734 5.64 6 Yes Yes 9 8 2 2
R:R:R720 R:R:R724 5.33 6 No Yes 6 8 2 2
R:R:D725 R:R:R720 3.57 6 Yes No 4 6 1 2
R:R:D725 R:R:R724 5.96 6 Yes Yes 4 8 1 2
R:R:F780 R:R:R724 7.48 6 Yes Yes 8 8 1 2
R:R:D725 R:R:M728 2.77 6 Yes No 4 7 1 1
R:R:D725 R:R:F780 14.33 6 Yes Yes 4 8 1 1
R:R:D725 R:R:M794 4.16 6 Yes Yes 4 9 1 2
R:R:D725 W:W:?1 16.6 6 Yes Yes 4 0 1 0
R:R:M728 W:W:?1 4.32 6 No Yes 7 0 1 0
R:R:S731 W:W:?1 3.44 6 No Yes 7 0 1 0
R:R:L732 W:W:?1 12.69 0 No Yes 8 0 1 0
R:R:N735 R:R:Y734 2.33 6 Yes Yes 7 8 1 2
R:R:L738 R:R:Y734 9.38 0 No Yes 9 8 2 2
R:R:N735 W:W:?1 11.54 6 Yes Yes 7 0 1 0
R:R:I739 R:R:M766 8.75 6 No No 8 9 1 2
R:R:I739 W:W:?1 2.18 6 No Yes 8 0 1 0
R:R:F776 R:R:W773 7.02 6 Yes Yes 9 9 1 1
R:R:S797 R:R:W773 3.71 6 No Yes 9 9 2 1
R:R:S801 R:R:W773 3.71 0 No Yes 9 9 2 1
R:R:W773 W:W:?1 21.76 6 Yes Yes 9 0 1 0
R:R:F776 R:R:F780 4.29 6 Yes Yes 9 8 1 1
R:R:F776 R:R:T793 5.19 6 Yes No 9 8 1 2
R:R:F776 R:R:M794 3.73 6 Yes Yes 9 9 1 2
R:R:F776 R:R:S797 3.96 6 Yes No 9 9 1 2
R:R:F776 W:W:?1 3.72 6 Yes Yes 9 0 1 0
R:R:F780 R:R:Q790 4.68 6 Yes Yes 8 7 1 2
R:R:F780 R:R:M794 2.49 6 Yes Yes 8 9 1 2
R:R:F780 W:W:?1 4.65 6 Yes Yes 8 0 1 0
R:R:V736 W:W:?1 1.14 0 No Yes 5 0 1 0
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub8.00
Average Interaction Strength8.00
Average Nodes In Shell31.00
Average Hubs In Shell16.00
Average Links In Shell53.00
Average Links Mediated by Hubs In Shell51.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8JD5 C Aminoacid Metabotropic Glutamate mGlu2; mGlu4 Homo Sapiens Glutamate BQI; HZE; PEF Gi1/Beta1/Gamma2 3.6 2023-06-21 10.1038/s41422-023-00830-2

A 2D representation of the interactions of HZR in 8JD5
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:L639 R:R:M619 4.24 4 Yes Yes 8 7 1 2
R:R:F643 R:R:L639 2.44 4 Yes Yes 8 8 1 1
R:R:L639 R:R:M728 2.83 4 Yes No 8 7 1 1
R:R:L639 W:W:?1 3.17 4 Yes Yes 8 0 1 0
R:R:F643 R:R:Y647 3.09 4 Yes Yes 8 6 1 1
R:R:F643 R:R:N735 2.42 4 Yes Yes 8 7 1 1
R:R:F643 R:R:W773 2 4 Yes Yes 8 9 1 1
R:R:F643 R:R:V798 7.87 4 Yes Yes 8 8 1 2
R:R:F643 R:R:S801 3.96 4 Yes Yes 8 9 1 2
R:R:F643 W:W:?1 10.24 4 Yes Yes 8 0 1 0
R:R:N735 R:R:S644 2.98 4 Yes No 7 8 1 2
R:R:C646 R:R:Y647 2.69 0 Yes Yes 6 6 2 1
R:R:I739 R:R:Y647 7.25 4 Yes Yes 8 6 1 1
R:R:M766 R:R:Y647 2.39 4 Yes Yes 9 6 2 1
R:R:T769 R:R:Y647 6.24 4 Yes Yes 8 6 1 1
R:R:V805 R:R:Y647 3.79 0 No Yes 7 6 2 1
R:R:Y647 W:W:?1 2.69 4 Yes Yes 6 0 1 0
R:R:D725 R:R:H723 7.56 4 No Yes 4 5 1 2
R:R:D725 R:R:F780 2.39 4 No Yes 4 8 1 1
R:R:D725 W:W:?1 3.11 4 No Yes 4 0 1 0
R:R:M728 W:W:?1 6.48 4 No Yes 7 0 1 0
R:R:L732 W:W:?1 12.69 0 No Yes 8 0 1 0
R:R:L738 R:R:N735 4.12 0 No Yes 9 7 2 1
R:R:N735 W:W:?1 7.35 4 Yes Yes 7 0 1 0
R:R:I739 R:R:L738 2.85 4 Yes No 8 9 1 2
R:R:I739 R:R:M766 4.37 4 Yes Yes 8 9 1 2
R:R:I739 W:W:?1 3.27 4 Yes Yes 8 0 1 0
R:R:M766 R:R:T765 3.01 4 Yes Yes 9 9 2 2
R:R:T765 R:R:T769 1.57 4 Yes Yes 9 8 2 1
R:R:T765 R:R:V804 1.59 4 Yes Yes 9 7 2 2
R:R:T765 R:R:V805 3.17 4 Yes No 9 7 2 2
R:R:T769 R:R:W773 2.43 4 Yes Yes 8 9 1 1
R:R:S801 R:R:T769 1.6 4 Yes Yes 9 8 2 1
R:R:T769 R:R:V804 1.59 4 Yes Yes 8 7 1 2
R:R:T769 W:W:?1 2.25 4 Yes Yes 8 0 1 0
R:R:F776 R:R:W773 6.01 4 Yes Yes 9 9 2 1
R:R:S797 R:R:W773 2.47 4 No Yes 9 9 2 1
R:R:V798 R:R:W773 2.45 4 Yes Yes 8 9 2 1
R:R:S801 R:R:W773 6.18 4 Yes Yes 9 9 2 1
R:R:W773 W:W:?1 20.02 4 Yes Yes 9 0 1 0
R:R:F776 R:R:F780 2.14 4 Yes Yes 9 8 2 1
R:R:F776 R:R:M794 2.49 4 Yes No 9 9 2 2
R:R:F776 R:R:S797 7.93 4 Yes No 9 9 2 2
R:R:L777 R:R:P778 1.64 4 No Yes 7 8 1 2
R:R:L777 W:W:?1 3.17 4 No Yes 7 0 1 0
R:R:L777 X:X:?2 3.41 4 No Yes 7 0 1 2
R:R:P778 S:S:W587 4.05 4 Yes Yes 8 5 2 2
R:R:P778 X:X:?2 9.45 4 Yes Yes 8 0 2 2
R:R:F780 R:R:Y781 5.16 4 Yes No 8 6 1 1
R:R:F780 R:R:Q790 14.05 4 Yes No 8 7 1 2
R:R:F780 R:R:M794 2.49 4 Yes No 8 9 1 2
R:R:F780 W:W:?1 9.31 4 Yes Yes 8 0 1 0
R:R:Y781 S:S:W587 4.82 4 No Yes 6 5 1 2
R:R:Y781 W:W:?1 8.06 4 No Yes 6 0 1 0
S:S:W587 X:X:?2 8.42 4 Yes Yes 5 0 2 2
R:R:L732 R:R:V736 1.49 0 No No 8 5 1 2
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub8.00
Average Interaction Strength7.06
Average Nodes In Shell33.00
Average Hubs In Shell21.00
Average Links In Shell56.00
Average Links Mediated by Hubs In Shell55.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links12.50
Average Number Of Links With An Hub6.50
Average Interaction Strength8.41
Average Nodes In Shell28.17
Average Hubs In Shell13.00
Average Links In Shell44.50
Average Links Mediated by Hubs In Shell41.67

missing image


Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

missing image


Location of the nodes interacting with this ligand

(Click to enlarge 🔍)