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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02846846

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
CVB4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACIDA,B1KE00.72
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1DPM0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6B0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1PSC0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B3E3H0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1QW70.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6C0.73
OXEORTHO-XYLENEA,B3E0X0.74
OXEORTHO-XYLENEA188L0.74
GB5(2E)-3-(4-CHLOROPHENYL)-N-HYDROXYACRYLAMIDEA,B2ILP0.71
MBNTOLUENEA,B3D7O0.75
MBNTOLUENEA,B1R1X0.75
MBNTOLUENEA,B1JLX0.75
MBNTOLUENEA,B,C,D3D170.75
MBNTOLUENEA,B2VRL0.75
MBNTOLUENEA,I2Z3E0.75
MBNTOLUENEA,B1YZI0.75
MBNTOLUENEA,B2DN10.75
MBNTOLUENEA,B3EN10.75
3PL3-PHENYLPROPANALE1Y3G0.8
AC01-PHENYLETHANONEA1ZK10.73
AC01-PHENYLETHANONEA1ZK40.73
PYLPHENYLETHANEC1B070.76
PYLPHENYLETHANEA,B2VRM0.76
PYLPHENYLETHANEA1NHB0.76
I4BISOBUTYLBENZENEA184L0.74
N4BN-BUTYLBENZENEA186L0.76
1LPTRANYLCYPROMINEA,B1OJB0.77
TCAPHENYLETHYLENECARBOXYLIC ACIDA1BE60.73
TCAPHENYLETHYLENECARBOXYLIC ACIDA1BE80.73
TCAPHENYLETHYLENECARBOXYLIC ACIDA,B,C,D,E,F,
G,H
2O780.73
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.72
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.74
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.75
HBXbenzaldehydeA,B3GDN0.77
FPRPROPYLBENZENEC1RHK0.76
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.71
HY1PHENYLACETALDEHYDED,H2I0S0.79
HY1PHENYLACETALDEHYDEA,B1D6Y0.79
HY1PHENYLACETALDEHYDEA,B1D6Z0.79
HY1PHENYLACETALDEHYDED,H2OK40.79
HY1PHENYLACETALDEHYDEA,B1D6U0.79