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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03260301

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OLZO-(2-aminoethyl)-L-serineA3DJ00.74
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.77
THCN-METHYLCARBONYLTHREONINEB2HR00.77
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.77
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.77
MAAN-METHYLALANINEA,B1A7Z0.75
MAAN-METHYLALANINEA,B2VSL0.75
MAAN-METHYLALANINEC1CWI0.75
MAAN-METHYLALANINEC,F,G,H3DW80.75
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.75
MAAN-METHYLALANINED1D5X0.75
MAAN-METHYLALANINEC1PYW0.75
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.75
MAAN-METHYLALANINEC,I2IE30.75
MAAN-METHYLALANINEC,F,X,Y2NPP0.75
DTHD-THREONINEA1KRO0.71
DTHD-THREONINEA,B,C,D3BOG0.71
DTHD-THREONINEA,B173D0.71
DTHD-THREONINEA209D0.71
DTHD-THREONINEA316D0.71
DTHD-THREONINEA,B2Q330.71
DTHD-THREONINEA2JUE0.71
DTHD-THREONINEA2D550.71
MVAN-METHYLVALINEA209D0.7
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H
3BO70.7
MVAN-METHYLVALINEC1CWH0.7
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.7
MVAN-METHYLVALINEA1DSD0.7
MVAN-METHYLVALINEB1L1V0.7
MVAN-METHYLVALINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.7
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMB0.7
MVAN-METHYLVALINEC1CWO0.7
MVAN-METHYLVALINEC1CWL0.7
MVAN-METHYLVALINEB1MIK0.7
MVAN-METHYLVALINEA1CSA0.7
MVAN-METHYLVALINEC1CWM0.7
MVAN-METHYLVALINEA1PFE0.7
MVAN-METHYLVALINEA,B,D,E,F,H1M630.7
MVAN-METHYLVALINEC1CWC0.7
MVAN-METHYLVALINEB,D,F,H2RMC0.7
MVAN-METHYLVALINEC1CWK0.7
MVAN-METHYLVALINEC1CYN0.7
MVAN-METHYLVALINEC,D1MNV0.7
MVAN-METHYLVALINEC,D2OJU0.7
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMA0.7
MVAN-METHYLVALINEA1CYB0.7
MVAN-METHYLVALINED1QNG0.7
MVAN-METHYLVALINEA,C,E,G2ADW0.7
MVAN-METHYLVALINEC1CWB0.7
MVAN-METHYLVALINEA,B,C,D,E,F1UNM0.7
MVAN-METHYLVALINEA,B1OVF0.7
MVAN-METHYLVALINEA,B185D0.7
MVAN-METHYLVALINEA1XVK0.7
MVAN-METHYLVALINEA,C1XVR0.7
MVAN-METHYLVALINEA,B173D0.7
MVAN-METHYLVALINEA,B1FJA0.7
MVAN-METHYLVALINEB3CYS0.7
MVAN-METHYLVALINEA,B,C1A7Y0.7
MVAN-METHYLVALINEA,B,C1L5G0.7
MVAN-METHYLVALINEA,B,C,D1I3W0.7
MVAN-METHYLVALINEA316D0.7
MVAN-METHYLVALINEA1XVN0.7
MVAN-METHYLVALINEC1IKF0.7
MVAN-METHYLVALINEA,M,N2Z6W0.7
MVAN-METHYLVALINEA,B,C1QFI0.7
MVAN-METHYLVALINEA,B3GO30.7
MVAN-METHYLVALINEC1CWA0.7
MVAN-METHYLVALINEC1CWF0.7
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P
1C5F0.7
MVAN-METHYLVALINED,E,F1XQ70.7
MVAN-METHYLVALINEA1CYA0.7
MVAN-METHYLVALINEA,B,D1MF80.7
MVAN-METHYLVALINEA,B1A7Z0.7
MVAN-METHYLVALINEA1DSC0.7
MVAN-METHYLVALINET,U,V2POY0.7
MVAN-METHYLVALINEA2D550.7
MVAN-METHYLVALINEC1BCK0.7
MVAN-METHYLVALINEC1CWI0.7
MVAN-METHYLVALINEC,D1QNH0.7
MVAN-METHYLVALINEA1VS20.7
HY33-HYDROXYPROLINEA,B,G2G660.71
DSEN-METHYL-D-SERINEC1CWH0.87
SENO-[N,N-dimethylphosphoramidate]-
L-serine
A3DKK0.7
SENO-[N,N-dimethylphosphoramidate]-
L-serine
A,B3DL70.7
DSND-SERINEA1XVN0.75
DSND-SERINEA2IGZ0.75
DSND-SERINEA,B,C,D2R3C0.75
DSND-SERINEA1BFW0.75
DSND-SERINEA,B,C2W160.75
DSND-SERINEA,B185D0.75
DSND-SERINEA,B,C,D3BOG0.75
DSND-SERINEA1XVK0.75
DSND-SERINEA,C1XVR0.75
DSND-SERINEA,L1ZEA0.75
DSND-SERINEA,B,C,D1UHG0.75
DSND-SERINEA1T5M0.75
DSND-SERINEC,D193D0.75
DSND-SERINEA2V3U0.75
DSND-SERINEA,B3GO30.75
DSND-SERINEA,B2RCB0.75
DSND-SERINEA1T5N0.75
DSND-SERINEB2HH40.75
DSND-SERINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.75
DSND-SERINEA,B,C2UZP0.75
DSND-SERINEA1TD40.75
DSND-SERINEA1PB80.75
DSND-SERINEA1PFE0.75
DSND-SERINEA,B2DA80.75
DSND-SERINEA2JUE0.75
DSND-SERINEA1XT70.75
DSND-SERINEA2IH00.75
DSND-SERINEA,B2RC80.75
DSND-SERINEA,B2Q330.75
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.81
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.81
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.81
SACN-ACETYL-SERINEA1R4U0.81
SACN-ACETYL-SERINEA,B,C,D1WS30.81
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.81
SACN-ACETYL-SERINEA,B1EVU0.81
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.81
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.81
SACN-ACETYL-SERINEA1WRR0.81
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.81
SACN-ACETYL-SERINEA,B3CVQ0.81
SACN-ACETYL-SERINEA1B0B0.81
SACN-ACETYL-SERINEA1XT40.81
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.81
SACN-ACETYL-SERINEA2FXL0.81
SACN-ACETYL-SERINEA1R4S0.81
SACN-ACETYL-SERINEA,B,C,D1WS20.81
SACN-ACETYL-SERINEA,B,C,D2AUC0.81
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.81
SACN-ACETYL-SERINEA1R510.81
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.81
SACN-ACETYL-SERINEA,B,C,D1XXJ0.81
SACN-ACETYL-SERINET2QAC0.81
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.81
CL5N-(3-OXOPROPYL)GLYCINEA2IOT0.74
IPGN-ISOPROPYL GLYCINEC,D2SEM0.73
AYAN-ACETYLALANINEA1D0W0.71
AYAN-ACETYLALANINEA1AH40.71
AYAN-ACETYLALANINEA,B1VBP0.71
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.71
AYAN-ACETYLALANINEA,B,C,D1OUW0.71
AYAN-ACETYLALANINEA1AH30.71
AYAN-ACETYLALANINEA1EKO0.71
AYAN-ACETYLALANINEB,D,F,H2V4I0.71
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.71
AYAN-ACETYLALANINEA,B,C,D1J4U0.71
SVASERINE VANADATEA,B1B8J0.71
ALOALLO-THREONINEI,P1HDT0.71
ALOALLO-THREONINEA2JUU0.71
ALOALLO-THREONINEA2VMX0.71