Code8QY
NamePZM21
SynonymsPZM21
Identifier1-[(2~{S})-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-3-[(2~{S})-1-thiophen-3-ylpropan-2-yl]urea
FormulaC19 H27 N3 O2 S
Molecular Weight361.502
SMILESC[C@@H](Cc1ccsc1)NC(=O)NC[C@H](Cc2ccc(cc2)O)N(C)C
PubChem121596705
Formal Charge0
Total Atoms52
Total Chiral Atoms2
Total Bonds53
Total Aromatic Bonds11
Networks2
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This ligand is also present in the following 2 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7SBF A Peptide Opioid MOP Mus musculus PZM21 - Gi1/Beta1/Gamma2 2.9 2022-04-20 10.1002/anie.202200269

A 2D representation of the interactions of 8QY in 7SBF
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:Q124 R:R:Y75 4.51 2 Yes No 6 7 1 2
R:R:I322 R:R:Y75 8.46 2 Yes No 5 7 1 2
R:R:Q124 R:R:T120 4.25 2 Yes Yes 6 6 1 2
R:R:T120 R:R:V143 3.17 0 Yes Yes 6 5 2 1
R:R:D147 R:R:T120 5.78 2 No Yes 6 6 1 2
R:R:L121 R:R:Q124 3.99 2 Yes Yes 7 6 2 1
R:R:L121 R:R:Y326 11.72 2 Yes Yes 7 7 2 1
R:R:F123 R:R:L139 3.65 2 Yes No 6 6 2 2
R:R:F123 R:R:V143 3.93 2 Yes Yes 6 5 2 1
R:R:Q124 R:R:Y326 11.27 2 Yes Yes 6 7 1 1
L:L:?1 R:R:Q124 4.36 2 Yes Yes 0 6 0 1
R:R:L139 R:R:V143 2.98 2 No Yes 6 5 2 1
R:R:C140 R:R:I144 3.27 2 No No 9 5 2 1
L:L:?1 R:R:V143 3.66 2 Yes Yes 0 5 0 1
R:R:A206 R:R:I144 3.25 0 No No 4 5 2 1
L:L:?1 R:R:I144 12.87 2 Yes No 0 5 0 1
R:R:D147 R:R:Y326 10.34 2 No Yes 6 7 1 1
L:L:?1 R:R:D147 21.14 2 Yes No 0 6 0 1
R:R:V202 R:R:Y148 6.31 2 No No 5 4 2 1
R:R:L219 R:R:Y148 3.52 2 No No 5 4 2 1
L:L:?1 R:R:Y148 4.81 2 Yes No 0 4 0 1
R:R:I155 R:R:M151 2.92 2 Yes Yes 8 7 2 1
R:R:M151 R:R:V236 3.04 2 Yes No 7 5 1 1
R:R:A240 R:R:M151 3.22 2 No Yes 6 7 2 1
R:R:M151 R:R:W293 5.82 2 Yes Yes 7 8 1 2
R:R:H297 R:R:M151 2.63 2 Yes Yes 8 7 1 1
L:L:?1 R:R:M151 9.27 2 Yes Yes 0 7 0 1
R:R:F152 R:R:V236 3.93 0 Yes No 7 5 2 1
R:R:A240 R:R:F152 2.77 2 No Yes 6 7 2 2
R:R:I155 R:R:W293 4.7 2 Yes Yes 8 8 2 2
R:R:L219 R:R:V202 4.47 2 No No 5 5 2 2
L:L:?1 R:R:V236 7.33 2 Yes No 0 5 0 1
R:R:F237 R:R:F241 5.36 2 Yes Yes 5 8 2 2
R:R:F237 R:R:H297 9.05 2 Yes Yes 5 8 2 1
R:R:A240 R:R:H297 2.93 2 No Yes 6 8 2 1
R:R:F241 R:R:H297 13.58 2 Yes Yes 8 8 2 1
R:R:H297 R:R:W293 3.17 2 Yes Yes 8 8 1 2
R:R:I296 R:R:V300 3.07 2 Yes No 6 5 2 1
R:R:I296 R:R:W318 3.52 2 Yes Yes 6 5 2 2
R:R:I296 R:R:I322 4.42 2 Yes Yes 6 5 2 1
L:L:?1 R:R:H297 3.16 2 Yes Yes 0 8 0 1
L:L:?1 R:R:V300 7.33 2 Yes No 0 5 0 1
R:R:I322 R:R:W318 10.57 2 Yes Yes 5 5 1 2
L:L:?1 R:R:I322 5.85 2 Yes Yes 0 5 0 1
L:L:?1 R:R:Y326 12.49 2 Yes Yes 0 7 0 1
L:L:?1 R:R:K233 2.31 2 Yes No 0 4 0 1
R:R:A304 R:R:K233 1.61 0 No No 4 4 2 1
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub6.00
Average Interaction Strength7.88
Average Nodes In Shell31.00
Average Hubs In Shell17.00
Average Links In Shell47.00
Average Links Mediated by Hubs In Shell41.00
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
8EFO A Peptide Opioid MOP Homo sapiens PZM21 - Gi1/Beta1/Gamma2 2.8  2022-11-09 10.1016/j.cell.2022.09.041

A 2D representation of the interactions of 8QY in 8EFO
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:I324 R:R:Y77 7.25 0 No No 5 7 1 2
R:R:Q126 R:R:T122 5.67 4 Yes No 6 6 1 2
R:R:D149 R:R:T122 7.23 4 Yes No 5 6 1 2
R:R:L123 R:R:Y328 16.41 0 No Yes 7 7 2 1
R:R:D149 R:R:Q126 5.22 4 Yes Yes 5 6 1 1
R:R:Q126 R:R:Y328 10.15 4 Yes Yes 6 7 1 1
L:L:?1 R:R:Q126 13.09 4 Yes Yes 0 6 0 1
R:R:C142 R:R:I146 3.27 4 Yes Yes 9 4 2 1
R:R:C142 R:R:C219 7.28 4 Yes No 9 9 2 2
R:R:A208 R:R:I146 6.5 0 No Yes 5 4 2 1
R:R:C219 R:R:I146 4.91 4 No Yes 9 4 2 1
L:L:?1 R:R:I146 7.02 4 Yes Yes 0 4 0 1
R:R:D149 R:R:Y328 8.05 4 Yes Yes 5 7 1 1
L:L:?1 R:R:D149 26.7 4 Yes Yes 0 5 0 1
R:R:V204 R:R:Y150 8.83 4 No No 5 4 2 1
R:R:L221 R:R:Y150 7.03 4 No No 4 4 2 1
L:L:?1 R:R:Y150 11.53 4 Yes No 0 4 0 1
R:R:F154 R:R:M153 3.73 0 Yes No 6 7 2 1
R:R:M153 R:R:W295 5.82 0 No Yes 7 8 1 2
L:L:?1 R:R:M153 8.11 4 Yes No 0 7 0 1
R:R:F154 R:R:V238 5.24 0 Yes No 6 5 2 1
R:R:L221 R:R:V204 4.47 4 No No 4 5 2 2
R:R:K235 R:R:V302 4.55 0 Yes No 4 5 2 1
L:L:?1 R:R:V238 12.21 4 Yes No 0 5 0 1
L:L:?1 R:R:V302 10.99 4 Yes No 0 5 0 1
R:R:I324 R:R:W320 7.05 0 No Yes 5 4 1 2
L:L:?1 R:R:I324 7.02 4 Yes No 0 5 0 1
L:L:?1 R:R:Y328 5.77 4 Yes Yes 0 7 0 1
R:R:A119 R:R:Y328 2.67 0 No Yes 7 7 2 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub4.00
Average Interaction Strength11.38
Average Nodes In Shell23.00
Average Hubs In Shell10.00
Average Links In Shell29.00
Average Links Mediated by Hubs In Shell25.00
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 Links10.50
Average Number Of Links With An Hub5.00
Average Interaction Strength9.63
Average Nodes In Shell27.00
Average Hubs In Shell13.50
Average Links In Shell38.00
Average Links Mediated by Hubs In Shell33.00

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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 🔍)