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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01752578

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.73
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.7
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.72
NC44-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}BUTANOIC ACIDA1ZD30.74
NC77-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}HEPTANOIC ACIDA1ZD50.76
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.72
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.72
TCOTERT-BUTYL(1S)-1-CYCLOHEXYL-2-OXOETHYLCARBAMATEA1Q6K0.71
NC3N-[(CYCLOHEXYLAMINO)CARBONYL]GLYCINEP1ZD20.79
MLEN-METHYLLEUCINEA,D2J9A0.72
MLEN-METHYLLEUCINEC1IKF0.72
MLEN-METHYLLEUCINEA,M,N2Z6W0.72
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.72
MLEN-METHYLLEUCINED,E,F1XQ70.72
MLEN-METHYLLEUCINEC1CWA0.72
MLEN-METHYLLEUCINEC1CWF0.72
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.72
MLEN-METHYLLEUCINEB3CYS0.72
MLEN-METHYLLEUCINEC1CWH0.72
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.72
MLEN-METHYLLEUCINEC1CYN0.72
MLEN-METHYLLEUCINEA1LV90.72
MLEN-METHYLLEUCINEC,D2OJU0.72
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.72
MLEN-METHYLLEUCINEA1IKM0.72
MLEN-METHYLLEUCINEC1CWK0.72
MLEN-METHYLLEUCINEA,B2HG80.72
MLEN-METHYLLEUCINEC1CWB0.72
MLEN-METHYLLEUCINEC1CWJ0.72
MLEN-METHYLLEUCINEA1CYB0.72
MLEN-METHYLLEUCINED1QNG0.72
MLEN-METHYLLEUCINEB1MIK0.72
MLEN-METHYLLEUCINEA1CSA0.72
MLEN-METHYLLEUCINEC1CWL0.72
MLEN-METHYLLEUCINEA1CYA0.72
MLEN-METHYLLEUCINEA,B,D1MF80.72
MLEN-METHYLLEUCINEC1BCK0.72
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.72
MLEN-METHYLLEUCINEC1CWC0.72
MLEN-METHYLLEUCINEC1CWI0.72
MLEN-METHYLLEUCINEC,D1QNH0.72
MLEN-METHYLLEUCINEB,D,F,H2RMC0.72
MLEN-METHYLLEUCINEC1CWM0.72
MLEN-METHYLLEUCINET,U,V2POY0.72
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.72
MLEN-METHYLLEUCINEC1CWO0.72
MLEN-METHYLLEUCINEA1IKL0.72
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.73
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.77
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.73
ALYN(6)-ACETYLLYSINEA,B2B4D0.7
ALYN(6)-ACETYLLYSINEA,B2OD90.7
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.7
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.7
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.7
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.7
ALYN(6)-ACETYLLYSINEA,B2B5G0.7
ALYN(6)-ACETYLLYSINEA2GIV0.7
ALYN(6)-ACETYLLYSINEB2RNY0.7
ALYN(6)-ACETYLLYSINEA1JSP0.7
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.7
ALYN(6)-ACETYLLYSINEA,D3D4B0.7
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.7
ALYN(6)-ACETYLLYSINEA,B2R0Y0.7
ALYN(6)-ACETYLLYSINEA3CZ70.7
ALYN(6)-ACETYLLYSINEA1JM40.7
ALYN(6)-ACETYLLYSINEA,B2H4H0.7
ALYN(6)-ACETYLLYSINEA,B2J6V0.7
ALYN(6)-ACETYLLYSINEA,B2R100.7
ALYN(6)-ACETYLLYSINEA,B1YC50.7
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.7
ALYN(6)-ACETYLLYSINEA,B2H2G0.7
ALYN(6)-ACETYLLYSINEA,D2H4F0.7
ALYN(6)-ACETYLLYSINEA2OU20.7
ALYN(6)-ACETYLLYSINEA,B1S5P0.7
ALYN(6)-ACETYLLYSINEB2RNW0.7
ALYN(6)-ACETYLLYSINEA3D350.7
ALYN(6)-ACETYLLYSINEA,B2OD20.7
ALYN(6)-ACETYLLYSINEA2ZFN0.7
ALYN(6)-ACETYLLYSINEC,D2C1J0.7
ALYN(6)-ACETYLLYSINEA,B2QQG0.7
ALYN(6)-ACETYLLYSINEB2RNX0.7
ALYN(6)-ACETYLLYSINEA,B1MA30.7
ALYN(6)-ACETYLLYSINEA,B2H2H0.7
ALYN(6)-ACETYLLYSINEA2I2Z0.7
ALYN(6)-ACETYLLYSINEA,B2OD70.7
ALYN(6)-ACETYLLYSINEP1E6I0.7
ALYN(6)-ACETYLLYSINEA,B1SZC0.7
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.7
ALYN(6)-ACETYLLYSINEA,B2H2D0.7
ALYN(6)-ACETYLLYSINEA,B1Q1A0.7
ALYN(6)-ACETYLLYSINEA,B1SZD0.7
ALYN(6)-ACETYLLYSINEQ,R2E3K0.7
ALYN(6)-ACETYLLYSINEA2OZU0.7
ALYN(6)-ACETYLLYSINEA,B2QQF0.7
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.7
NC66-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}HEXANOIC ACIDA1ZD40.77
CIRCITRULLINEA,B,C,D1J210.7
CIRCITRULLINEB1KOD0.7
CIRCITRULLINEA,B,C3B3I0.7
CIRCITRULLINEC3DTX0.7
CIRCITRULLINEA2C6Z0.7
CIRCITRULLINEA,C,E,F2W650.7
CIRCITRULLINEA,B2JAI0.7
CIRCITRULLINEP3FT20.7
CIRCITRULLINEA,B,C,D1J1Z0.7
CIRCITRULLINEA,B1LXY0.7
CIRCITRULLINEF,H1OL10.7
CIRCITRULLINEA1KP30.7
CIRCITRULLINEA2NZ20.7
CIRCITRULLINEA1H700.7
CIRCITRULLINEA1K970.7
CIRCITRULLINEC3B6S0.7
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.75
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.72
IMLN-METHYL-ISOLEUCINEC1CWM0.72