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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02387561

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TEPTHEOPHYLLINEA1EHT0.75
TEPTHEOPHYLLINEA,B2A3A0.75
TEPTHEOPHYLLINEA1O150.75
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DY80.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2HD10.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYN0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYS0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2YY20.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3ECN0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYL0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D1ZKN0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2R8Q0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D,E,F,
G,H,I,J,K,L		1SOJ0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYQ0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA1RKP0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA1ZKL0.72
BRG8-BROMOGUANINEA,E1LWW0.87
2098-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE-
2,6-DIONE		A1RS20.78
AC29-HYROXYETHOXYMETHYLGUANINEA,B2KI50.71
AC29-HYROXYETHOXYMETHYLGUANINEE1PWY0.71
GUNGUANINEA,B1IT70.85
GUNGUANINEA,B,C,D3BP10.85
GUNGUANINEA1XT40.85
GUNGUANINEA1ULB0.85
GUNGUANINEA,B2I9U0.85
GUNGUANINEA2JH90.85
GUNGUANINEE1V2H0.85
GUNGUANINEA2JHA0.85
GUNGUANINEA,B,C,D1A950.85
GUNGUANINEA,B,C1XE70.85
GUNGUANINEA,B,C1YQQ0.85
GUNGUANINEA,B1D6A0.85
GUNGUANINEA1WET0.85
GUNGUANINEA2PUF0.85
GUNGUANINEA,B,D,F,G,H,
I,J,L,M,O,P		1SQL0.85
GUNGUANINEA,B,C1VMK0.85
GUNGUANINEA,B,C1YQU0.85
GUNGUANINEA2JHC0.85
GUNGUANINEA2JH80.85
GUNGUANINEA2JHP0.85
GUNGUANINEA2PUC0.85
GUNGUANINEA,B,C,D,E,F,
G,H		1XY30.85
GUNGUANINEA,B,C,D,E,F2O740.85
GUNGUANINEA2PWU0.85
GUNGUANINEA2OOD0.85
GUNGUANINEA2POT0.85
37TTHEOBROMINEA2EFJ0.72
XANXANTHINEA3GAO0.76
XANXANTHINE2,3,4,A,B,C,
J,K,L,S,T,U		3EUB0.76
XANXANTHINEA,B,C,D,E,F1YR30.76
XANXANTHINEA2UZ90.76
XANXANTHINEA,B,C,D,E,F,
G,H		2W3S0.76
XANXANTHINEA,B,C,D1A960.76
HPAHYPOXANTHINEA1PNR0.85
HPAHYPOXANTHINEA2EET0.85
HPAHYPOXANTHINEA2PUG0.85
HPAHYPOXANTHINEA1A9T0.85
HPAHYPOXANTHINEA1BDI0.85
HPAHYPOXANTHINEA1QQA0.85
HPAHYPOXANTHINEA1VFN0.85
HPAHYPOXANTHINEA1VPW0.85
HPAHYPOXANTHINEA2EEV0.85
HPAHYPOXANTHINEA1A9Q0.85
HPAHYPOXANTHINEA1A9R0.85
HPAHYPOXANTHINEA2EEU0.85
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H		2W550.85
HPAHYPOXANTHINEA1JFT0.85
HPAHYPOXANTHINEA2EEW0.85
HPAHYPOXANTHINEA2PUD0.85
HPAHYPOXANTHINEA1QP70.85
HPAHYPOXANTHINEA,M1ZAY0.85
HPAHYPOXANTHINEA1JH90.85
HPAHYPOXANTHINEA2EES0.85
HPAHYPOXANTHINEA1JFS0.85
HPAHYPOXANTHINEA1QP00.85
HPAHYPOXANTHINEA1QPZ0.85
HPAHYPOXANTHINEA1U8D0.85
HPAHYPOXANTHINEA1QQB0.85
HPAHYPOXANTHINEA1BDH0.85
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H		2W3R0.85
HPAHYPOXANTHINEA1QP40.85
HPAHYPOXANTHINEA,B,C3FNQ0.85
ANG8-AMINOGUANINEA,C1M3Q0.89
ANG8-AMINOGUANINEA,E1LWV0.89
H338-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO-
1H-PURINE-2,6-DIONE		A2UY30.81
8IG8-IODO-GUANINEA,B,C1C3X0.88
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE		A,B2IU30.77
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE		A,B2IU00.77
AMR3,5-DIAMINO-N-(AMINOIMINOMETHYL)-
6-CHLOROPYRAZINECARBOXAMIDE		A1F5L0.71
DX42-amino-1,9-dihydro-6H-purine-6-
thione		A,B,C,D3BMG0.7
5AC5-amino-1H-imidazole-4-carboxamideA,B3CL80.79