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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009040

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GZZN-{8-[(8-{[(E)-AMINO(IMINO)METHYL]AMINO}OCTYL)AMINO]OCTYL}GUANIDINEA,B,C1H820.76
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.71
AG2AGMATINEB,D,F,H,J,L1N131
AG2AGMATINEA,B,C,D,E,F,
H,I,J,K,L
2QQC1
AG2AGMATINEA,B,C,D,E2QQD1
AG2AGMATINEA,B,C,D,F,G,
H,J,K,L
1MT11
PG3GUANIDINE-3-PROPANOLA2A320.71
PG3GUANIDINE-3-PROPANOLA1S5S0.71
PG3GUANIDINE-3-PROPANOLA2A310.71
IHGN-ISOPROPYL-N'-HYDROXYGUANIDINEA,B1LZZ0.74
BHHN-BUTYL-N'-HYDROXYGUANIDINEA,B1M000.84
ALGGUANIDINOBUTYRYL GROUPI,P1HDT0.72
EGDN-ETHYLGUANIDINEA2F320.82
AHI3-{[(E)-AMINO(HYDROXYIMINO)METHYL]AMINO}PROPAN-
1-AMINIUM
A,B,C1T4R0.81
SBP[3-(1,3,2-DIOXABOROLAN-2-YLOXY)PROPYL]GUANIDINEA1S6F0.71
BOR(1R)-1-AMINO-4-{[(E)-AMINO(IMINO)METHYL]AMINO}BUTYLBORONIC ACIDA,B,C,D1OT50.91
BOR(1R)-1-AMINO-4-{[(E)-AMINO(IMINO)METHYL]AMINO}BUTYLBORONIC ACIDA,B,C,D1R640.91
AG31-{4-[(3-aminopropyl)amino]butyl}guanidineA,C,E2ZSU0.89
AG31-{4-[(3-aminopropyl)amino]butyl}guanidineA,B,C,D2E5W0.89