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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02850631

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.7
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.76
MBNTOLUENEA,B3D7O0.75
MBNTOLUENEA,B1R1X0.75
MBNTOLUENEA,B1JLX0.75
MBNTOLUENEA,B,C,D3D170.75
MBNTOLUENEA,B2VRL0.75
MBNTOLUENEA,I2Z3E0.75
MBNTOLUENEA,B1YZI0.75
MBNTOLUENEA,B2DN10.75
MBNTOLUENEA,B3EN10.75
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.72
BDBA,B1KE30.72
N4BN-BUTYLBENZENEA186L0.76
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.7
BNSHYDROSULFONYLBENZENE11YYY0.77
BNSHYDROSULFONYLBENZENEA1MEM0.77
BNSHYDROSULFONYLBENZENEA,D,E1FH00.77
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.77
DMX3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-
1-SULFONATE
A,B,C,D1TP70.71
I4BISOBUTYLBENZENEA184L0.76
B69A2ZCR0.74
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.74
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.74
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.74
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.74
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.87
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.87
MAJindane-5-sulfonamideA2QOA0.76
FPRPROPYLBENZENEC1RHK0.76
IBZ2-IODOBENZYLTHIO GROUPA,B1CEL0.71
2HT3-methylbenzonitrileA,B3F880.71
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.74
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.74
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.74
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.74
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.71
BPSA,B2DE40.86