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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02416893

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OXEORTHO-XYLENEA,B3E0X0.75
OXEORTHO-XYLENEA188L0.75
SS2(1R)-1-PHENYLETHANOLA1ZK00.71
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.71
SS2(1R)-1-PHENYLETHANOLA1ZJY0.71
CVB4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACIDA,B1KE00.7
PPP3-PHENYL-1,2-PROPANDIOLA,B1HRN0.72
BDBA,B1KE30.73
PXYPARA-XYLENEA187L0.77
PXYPARA-XYLENEA225L0.77
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.72
2HRHEXYLPHOSPHONIC ACID (R)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS10.73
2HSHEXYLPHOSPHONIC ACID (S)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS20.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1DPM0.78
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6B0.78
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1PSC0.78
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B3E3H0.78
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1QW70.78
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6C0.78
TCAPHENYLETHYLENECARBOXYLIC ACIDA1BE60.71
TCAPHENYLETHYLENECARBOXYLIC ACIDA1BE80.71
TCAPHENYLETHYLENECARBOXYLIC ACIDA,B,C,D,E,F,
G,H
2O780.71
FPRPROPYLBENZENEC1RHK0.77
787(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACIDA1O4R0.75
I4BISOBUTYLBENZENEA184L0.75
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.75
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.77
PEL2-PHENYL-ETHANOLA,B1I0D0.74
PEL2-PHENYL-ETHANOLD,H2I0T0.74
PEL2-PHENYL-ETHANOLA,B1HZY0.74
PEL2-PHENYL-ETHANOLA,B1I0B0.74
PEL2-PHENYL-ETHANOLA1EYW0.74
PEL2-PHENYL-ETHANOLA,B1JGM0.74
MBNTOLUENEA,B3D7O0.76
MBNTOLUENEA,B1R1X0.76
MBNTOLUENEA,B1JLX0.76
MBNTOLUENEA,B,C,D3D170.76
MBNTOLUENEA,B2VRL0.76
MBNTOLUENEA,I2Z3E0.76
MBNTOLUENEA,B1YZI0.76
MBNTOLUENEA,B2DN10.76
MBNTOLUENEA,B3EN10.76
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.72
SS11-PHENYLETHANOLH1UM50.71
N4BN-BUTYLBENZENEA186L0.77
PYLPHENYLETHANEC1B070.77
PYLPHENYLETHANEA,B2VRM0.77
PYLPHENYLETHANEA1NHB0.77