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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00124136

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.71
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.7
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.7
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.71
PRA3-PHENYLPROPYLAMINEA1TNK0.71
PRA3-PHENYLPROPYLAMINEM1UTL0.71
PBN4-PHENYLBUTYLAMINEA1TNI0.71
PBN4-PHENYLBUTYLAMINEA1UTP0.71
DENINDENEA183L0.75
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.75
AN3ANTHRACENEA,B2HMN0.8
AN3ANTHRACENEA,B2HMM0.8
PEYPHENANTHRENEA,B2HML0.8
PEYPHENANTHRENEA,B2HMK0.8
PYLPHENYLETHANEC1B070.76
PYLPHENYLETHANEA,B2VRM0.76
PYLPHENYLETHANEA1NHB0.76
MBNTOLUENEA,B3D7O0.73
MBNTOLUENEA,B1R1X0.73
MBNTOLUENEA,B1JLX0.73
MBNTOLUENEA,B,C,D3D170.73
MBNTOLUENEA,B2VRL0.73
MBNTOLUENEA,I2Z3E0.73
MBNTOLUENEA,B1YZI0.73
MBNTOLUENEA,B2DN10.73
MBNTOLUENEA,B3EN10.73
2HT3-methylbenzonitrileA,B3F880.86
N4BN-BUTYLBENZENEA186L0.76
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.79
PXYPARA-XYLENEA187L0.76
PXYPARA-XYLENEA225L0.76
I4BISOBUTYLBENZENEA184L0.76
BDBA,B1KE30.79
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.74
2631-(azidomethyl)-3-methylbenzeneX2RB20.71
NPYNAPHTHALENEA,B1O7G0.79
FPRPROPYLBENZENEC1RHK0.76
OXEORTHO-XYLENEA,B3E0X0.79
OXEORTHO-XYLENEA188L0.79