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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02348594

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PXYPARA-XYLENEA187L0.78
PXYPARA-XYLENEA225L0.78
PYLPHENYLETHANEC1B070.8
PYLPHENYLETHANEA,B2VRM0.8
PYLPHENYLETHANEA1NHB0.8
DENINDENEA183L0.75
MBNTOLUENEA,B3D7O0.77
MBNTOLUENEA,B1R1X0.77
MBNTOLUENEA,B1JLX0.77
MBNTOLUENEA,B,C,D3D170.77
MBNTOLUENEA,B2VRL0.77
MBNTOLUENEA,I2Z3E0.77
MBNTOLUENEA,B1YZI0.77
MBNTOLUENEA,B2DN10.77
MBNTOLUENEA,B3EN10.77
N4BN-BUTYLBENZENEA186L0.8
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.72
OXEORTHO-XYLENEA,B3E0X0.78
OXEORTHO-XYLENEA188L0.78
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.7
P4PTETRAPHENYLPHOSPHONIUMA,M1EXJ0.82
P4PTETRAPHENYLPHOSPHONIUMA,C3B620.82
P4PTETRAPHENYLPHOSPHONIUMA,B1R8E0.82
P4PTETRAPHENYLPHOSPHONIUMA2BOW0.82
P4PTETRAPHENYLPHOSPHONIUMA3B5D0.82
2HT3-methylbenzonitrileA,B3F880.7
TBC(9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENEA1N8C0.71
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.7
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.7
FPRPROPYLBENZENEC1RHK0.8
AN3ANTHRACENEA,B2HMN0.85
AN3ANTHRACENEA,B2HMM0.85
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.89
PEYPHENANTHRENEA,B2HML0.85
PEYPHENANTHRENEA,B2HMK0.85
I4BISOBUTYLBENZENEA184L0.81
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.78
GW5(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT-
1-ENYL]PHENYL}ACRYLIC ACID
A,B,C1R5K0.74
FEP[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)-
PHENYL]-BUTYL}-PHENYL)-DIFLUORO-
METHYL]-PHOSPHONIC ACID
A1KAV0.72
TTATETRAPHENYL-ARSONIUMA1HYV0.86
NPYNAPHTHALENEA,B1O7G0.81
118TETRAPHENYLANTIMONIUM IONA1EXI0.86
BDBA,B1KE30.81