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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02324809

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MBNTOLUENEA,B3D7O0.78
MBNTOLUENEA,B1R1X0.78
MBNTOLUENEA,B1JLX0.78
MBNTOLUENEA,B,C,D3D170.78
MBNTOLUENEA,B2VRL0.78
MBNTOLUENEA,I2Z3E0.78
MBNTOLUENEA,B1YZI0.78
MBNTOLUENEA,B2DN10.78
MBNTOLUENEA,B3EN10.78
TCZ1,3,5-TRICHLORO-BENZENEA,B,C,D1J510.72
FPRPROPYLBENZENEC1RHK0.75
OXEORTHO-XYLENEA,B3E0X0.73
OXEORTHO-XYLENEA188L0.73
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.85
BT6benzenethiolA,B,C,D3HSR0.81
PXYPARA-XYLENEA187L0.75
PXYPARA-XYLENEA225L0.75
IBZ2-IODOBENZYLTHIO GROUPA,B1CEL0.78
I4BISOBUTYLBENZENEA184L0.73
TTATETRAPHENYL-ARSONIUMA1HYV0.73
PBCPHENYL BORONIC ACIDA2A320.88
PBCPHENYL BORONIC ACIDA1JU30.88
PYLPHENYLETHANEC1B070.75
PYLPHENYLETHANEA,B2VRM0.75
PYLPHENYLETHANEA1NHB0.75
PHGPHENYLMERCURYA1CZS0.93
PA0Phenylarsine oxideA3E3Z0.91
YAN1,2-DICHLOROBENZENEX2OTY0.73
N4BN-BUTYLBENZENEA186L0.75
118TETRAPHENYLANTIMONIUM IONA1EXI0.73
PIHIODOPHENYLA1UO51
PIHIODOPHENYLA3DNA1
PIHIODOPHENYLA1F9O1
PIHIODOPHENYLA,B1UO41
PIHIODOPHENYLA3DN41
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.7
BNSHYDROSULFONYLBENZENE11YYY0.74
BNSHYDROSULFONYLBENZENEA1MEM0.74
BNSHYDROSULFONYLBENZENEA,D,E1FH00.74
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.74
FIB1,2,3,4,5-pentafluoro-6-iodobenzeneA3DN80.73
BNZBENZENEA1L830.93
BNZBENZENEA1CP40.93
BNZBENZENEA,B,C,D1XXJ0.93
BNZBENZENEB1SWI0.93
BNZBENZENEA181L0.93
BNZBENZENEA223L0.93
BNZBENZENEA3DMX0.93
BNZBENZENEA2Z9G0.93
BNZBENZENEA220L0.93
BNZBENZENEA227L0.93
BNZBENZENEA,B1A7Z0.93
BNZBENZENEA1L840.93
IBF1,2,3,4,5-pentafluoro-6-iodobenzeneA3DN30.73
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.73
F5B1,2,3,4,5-pentafluorobenzeneA3DN00.78