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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03504614

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FPRPROPYLBENZENEC1RHK0.75
PA0Phenylarsine oxideA3E3Z0.79
I4BISOBUTYLBENZENEA184L0.72
787(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACIDA1O4R0.7
BNSHYDROSULFONYLBENZENE11YYY0.71
BNSHYDROSULFONYLBENZENEA1MEM0.71
BNSHYDROSULFONYLBENZENEA,D,E1FH00.71
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.71
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.75
PXYPARA-XYLENEA187L0.75
PXYPARA-XYLENEA225L0.75
PVS(ethenylsulfonyl)benzeneA3BLU0.7
MBNTOLUENEA,B3D7O0.74
MBNTOLUENEA,B1R1X0.74
MBNTOLUENEA,B1JLX0.74
MBNTOLUENEA,B,C,D3D170.74
MBNTOLUENEA,B2VRL0.74
MBNTOLUENEA,I2Z3E0.74
MBNTOLUENEA,B1YZI0.74
MBNTOLUENEA,B2DN10.74
MBNTOLUENEA,B3EN10.74
OXEORTHO-XYLENEA,B3E0X0.72
OXEORTHO-XYLENEA188L0.72
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.72
SMLPHENYL METHYL SULFONEA,I1D6W0.71
SMLPHENYL METHYL SULFONEA,I1D9I0.71
PYLPHENYLETHANEC1B070.75
PYLPHENYLETHANEA,B2VRM0.75
PYLPHENYLETHANEA1NHB0.75
PBCPHENYL BORONIC ACIDA2A320.76
PBCPHENYL BORONIC ACIDA1JU30.76
N4BN-BUTYLBENZENEA186L0.75
BNZBENZENEA1L830.77
BNZBENZENEA1CP40.77
BNZBENZENEA,B,C,D1XXJ0.77
BNZBENZENEB1SWI0.77
BNZBENZENEA181L0.77
BNZBENZENEA223L0.77
BNZBENZENEA3DMX0.77
BNZBENZENEA2Z9G0.77
BNZBENZENEA220L0.77
BNZBENZENEA227L0.77
BNZBENZENEA,B1A7Z0.77
BNZBENZENEA1L840.77
PIHIODOPHENYLA1UO50.73
PIHIODOPHENYLA3DNA0.73
PIHIODOPHENYLA1F9O0.73
PIHIODOPHENYLA,B1UO40.73
PIHIODOPHENYLA3DN40.73
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.7
PHGPHENYLMERCURYA1CZS0.77
P4PTETRAPHENYLPHOSPHONIUMA,M1EXJ0.74
P4PTETRAPHENYLPHOSPHONIUMA,C3B620.74
P4PTETRAPHENYLPHOSPHONIUMA,B1R8E0.74
P4PTETRAPHENYLPHOSPHONIUMA2BOW0.74
P4PTETRAPHENYLPHOSPHONIUMA3B5D0.74
BT6benzenethiolA,B,C,D3HSR0.74
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1DPM0.71
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6B0.71
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1PSC0.71
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B3E3H0.71
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1QW70.71
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6C0.71