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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02634774

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NFP3-AMINO-5-PHENYLPENTANEA1MEM0.72
NFP3-AMINO-5-PHENYLPENTANEA,D,E1FH00.72
DENINDENEA183L0.74
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.83
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.74
PXYPARA-XYLENEA187L0.75
PXYPARA-XYLENEA225L0.75
2631-(azidomethyl)-3-methylbenzeneX2RB20.7
BDBA,B1KE30.78
BHYN,N'-[biphenyl-4,4'-diyldi(2R)propane-
2,1-diyl]dimethanesulfonamide
A,B3BBR0.71
FPRPROPYLBENZENEC1RHK0.77
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
NPYNAPHTHALENEA,B1O7G0.78
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.7
AN3ANTHRACENEA,B2HMN0.75
AN3ANTHRACENEA,B2HMM0.75
2HT3-methylbenzonitrileA,B3F880.82
OXEORTHO-XYLENEA,B3E0X0.8
OXEORTHO-XYLENEA188L0.8
L18(2S)-1-methyl-2-[(2S,4R)-2-methyl-
4-phenylpentyl]piperidine
A2JJG0.74
PEYPHENANTHRENEA,B2HML0.75
PEYPHENANTHRENEA,B2HMK0.75
N4BN-BUTYLBENZENEA186L0.77
PYLPHENYLETHANEC1B070.77
PYLPHENYLETHANEA,B2VRM0.77
PYLPHENYLETHANEA1NHB0.77
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.73
I4BISOBUTYLBENZENEA184L0.8