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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02306826

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PXYPARA-XYLENEA187L0.78
PXYPARA-XYLENEA225L0.78
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
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.79
BDBA,B1KE30.75
OXEORTHO-XYLENEA,B3E0X0.84
OXEORTHO-XYLENEA188L0.84
PYLPHENYLETHANEC1B070.81
PYLPHENYLETHANEA,B2VRM0.81
PYLPHENYLETHANEA1NHB0.81
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.76
AN3ANTHRACENEA,B2HMN0.71
AN3ANTHRACENEA,B2HMM0.71
NPYNAPHTHALENEA,B1O7G0.77
IBZ2-IODOBENZYLTHIO GROUPA,B1CEL0.7
N4BN-BUTYLBENZENEA186L0.81
PEYPHENANTHRENEA,B2HML0.71
PEYPHENANTHRENEA,B2HMK0.71
I4BISOBUTYLBENZENEA184L0.79
PRA3-PHENYLPROPYLAMINEA1TNK0.7
PRA3-PHENYLPROPYLAMINEM1UTL0.7
PBN4-PHENYLBUTYLAMINEA1TNI0.7
PBN4-PHENYLBUTYLAMINEA1UTP0.7
2602-(bromomethyl)-1,3-difluorobenzeneX2RB00.85
DENINDENEA183L0.81
FPRPROPYLBENZENEC1RHK0.81
2HT3-methylbenzonitrileA,B3F880.71
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.71
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.76