Ligand
Ligand Name:   TNP-470
Ligand Type:   non-polymer
Ligand ID:   COVPDB1389 PubChem:   5326425
Synonym(s):  
  •   (1r,2s,3s,4r)-4-hydroxy-2-methoxy-4-methyl-3-[(2r,3r)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]cyclohexyl (chloroacetyl)carbamate
  • schembl13852628
  • q27466590
show 2 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC(C)=CC[C@@H](O1)[C@@]1(C)[C@H]([C@]2(C)O)[C@H](OC)[C@@H](CC2)OC(=O)NC(=O)CCl
Standard InChI:   InChI=1S/C19H30ClNO6/c1-11(2)6-7-13-19(4,27-13)16-15(25-5)12(8-9-18(16,3)24)26-17(23)21-14(22)10-20/h6,12-13,15-16,24H,7-10H2,1-5H3,(H,21,22,23)/t12-,13-,15-,16+,18-,19+/m1/s1
Molecular Formula:   C19H30ClNO6 Mol. Weight:   403.17618 logP:   2.5364
HBD:   2 HBA:   6
#Rotatable Bonds:   6 TPSA:   97.39

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Methionine aminopeptidase 2 P50579 (MAP2_HUMAN) Homo sapiens (Human) 1B6A TN4
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SHOW
Methionine aminopeptidase 1 P53582 (MAP11_HUMAN) Homo sapiens (Human) 5YR6 TN4
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SHOW
Methionine aminopeptidase 1 P53582 (MAP11_HUMAN) Homo sapiens (Human) 5YR4 TN4
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SHOW