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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02234569

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
PA0Phenylarsine oxideA3E3Z0.81
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
PXYPARA-XYLENEA187L0.77
PXYPARA-XYLENEA225L0.77
PHGPHENYLMERCURYA1CZS0.8
BNZBENZENEA1L830.8
BNZBENZENEA1CP40.8
BNZBENZENEA,B,C,D1XXJ0.8
BNZBENZENEB1SWI0.8
BNZBENZENEA181L0.8
BNZBENZENEA223L0.8
BNZBENZENEA3DMX0.8
BNZBENZENEA2Z9G0.8
BNZBENZENEA220L0.8
BNZBENZENEA227L0.8
BNZBENZENEA,B1A7Z0.8
BNZBENZENEA1L840.8
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.72
FPRPROPYLBENZENEC1RHK0.77
787(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACIDA1O4R0.75
I4BISOBUTYLBENZENEA184L0.75
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.77
BNSHYDROSULFONYLBENZENE11YYY0.7
BNSHYDROSULFONYLBENZENEA1MEM0.7
BNSHYDROSULFONYLBENZENEA,D,E1FH00.7
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.7
PIHIODOPHENYLA1UO50.75
PIHIODOPHENYLA3DNA0.75
PIHIODOPHENYLA1F9O0.75
PIHIODOPHENYLA,B1UO40.75
PIHIODOPHENYLA3DN40.75
N4BN-BUTYLBENZENEA186L0.77
P4PTETRAPHENYLPHOSPHONIUMA,M1EXJ0.74
P4PTETRAPHENYLPHOSPHONIUMA,C3B620.74
P4PTETRAPHENYLPHOSPHONIUMA,B1R8E0.74
P4PTETRAPHENYLPHOSPHONIUMA2BOW0.74
P4PTETRAPHENYLPHOSPHONIUMA3B5D0.74
BDBA,B1KE30.71
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
PBCPHENYL BORONIC ACIDA2A320.82
PBCPHENYL BORONIC ACIDA1JU30.82
PYLPHENYLETHANEC1B070.77
PYLPHENYLETHANEA,B2VRM0.77
PYLPHENYLETHANEA1NHB0.77
BT6benzenethiolA,B,C,D3HSR0.73
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.71