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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03695558

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
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.74
FPRPROPYLBENZENEC1RHK0.75
BDBA,B1KE30.74
I4BISOBUTYLBENZENEA184L0.78
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.93
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.93
BNSHYDROSULFONYLBENZENE11YYY0.76
BNSHYDROSULFONYLBENZENEA1MEM0.76
BNSHYDROSULFONYLBENZENEA,D,E1FH00.76
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.76
MBNTOLUENEA,B3D7O0.72
MBNTOLUENEA,B1R1X0.72
MBNTOLUENEA,B1JLX0.72
MBNTOLUENEA,B,C,D3D170.72
MBNTOLUENEA,B2VRL0.72
MBNTOLUENEA,I2Z3E0.72
MBNTOLUENEA,B1YZI0.72
MBNTOLUENEA,B2DN10.72
MBNTOLUENEA,B3EN10.72
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.81
DENINDENEA183L0.7
BPSA,B2DE40.87
B69A2ZCR0.75
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.78
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.78
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.78
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.78
N4BN-BUTYLBENZENEA186L0.75
MAJindane-5-sulfonamideA2QOA0.82
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.78
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.78
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.78
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.78
NTSNAPHTHALENE TRISULFONATEA1RML0.79
HS4N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamideA3F170.7
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.83
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.83
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.83
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.75