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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00483042

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.74
MAAN-METHYLALANINEA,B1A7Z0.74
MAAN-METHYLALANINEA,B2VSL0.74
MAAN-METHYLALANINEC1CWI0.74
MAAN-METHYLALANINEC,F,G,H3DW80.74
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.74
MAAN-METHYLALANINED1D5X0.74
MAAN-METHYLALANINEC1PYW0.74
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.74
MAAN-METHYLALANINEC,I2IE30.74
MAAN-METHYLALANINEC,F,X,Y2NPP0.74
0AHO-(bromoacetyl)-L-serineA,B1PTH0.7
NXAN-CARBOXYALANINEA2IUX0.78
NXAN-CARBOXYALANINEA1O8A0.78
OLZO-(2-aminoethyl)-L-serineA3DJ00.73
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.96
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.96
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.96
SACN-ACETYL-SERINEA1R4U0.96
SACN-ACETYL-SERINEA,B,C,D1WS30.96
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.96
SACN-ACETYL-SERINEA,B1EVU0.96
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.96
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.96
SACN-ACETYL-SERINEA1WRR0.96
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.96
SACN-ACETYL-SERINEA,B3CVQ0.96
SACN-ACETYL-SERINEA1B0B0.96
SACN-ACETYL-SERINEA1XT40.96
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.96
SACN-ACETYL-SERINEA2FXL0.96
SACN-ACETYL-SERINEA1R4S0.96
SACN-ACETYL-SERINEA,B,C,D1WS20.96
SACN-ACETYL-SERINEA,B,C,D2AUC0.96
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.96
SACN-ACETYL-SERINEA1R510.96
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.96
SACN-ACETYL-SERINEA,B,C,D1XXJ0.96
SACN-ACETYL-SERINET2QAC0.96
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.96
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
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.74
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.75
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.75
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.75
DSEN-METHYL-D-SERINEC1CWH0.85
SVASERINE VANADATEA,B1B8J0.7
DSND-SERINEA1XVN0.7
DSND-SERINEA2IGZ0.7
DSND-SERINEA,B,C,D2R3C0.7
DSND-SERINEA1BFW0.7
DSND-SERINEA,B,C2W160.7
DSND-SERINEA,B185D0.7
DSND-SERINEA,B,C,D3BOG0.7
DSND-SERINEA1XVK0.7
DSND-SERINEA,C1XVR0.7
DSND-SERINEA,L1ZEA0.7
DSND-SERINEA,B,C,D1UHG0.7
DSND-SERINEA1T5M0.7
DSND-SERINEC,D193D0.7
DSND-SERINEA2V3U0.7
DSND-SERINEA,B3GO30.7
DSND-SERINEA,B2RCB0.7
DSND-SERINEA1T5N0.7
DSND-SERINEB2HH40.7
DSND-SERINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.7
DSND-SERINEA,B,C2UZP0.7
DSND-SERINEA1TD40.7
DSND-SERINEA1PB80.7
DSND-SERINEA1PFE0.7
DSND-SERINEA,B2DA80.7
DSND-SERINEA2JUE0.7
DSND-SERINEA1XT70.7
DSND-SERINEA2IH00.7
DSND-SERINEA,B2RC80.7
DSND-SERINEA,B2Q330.7
AYAN-ACETYLALANINEA1D0W0.83
AYAN-ACETYLALANINEA1AH40.83
AYAN-ACETYLALANINEA,B1VBP0.83
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.83
AYAN-ACETYLALANINEA,B,C,D1OUW0.83
AYAN-ACETYLALANINEA1AH30.83
AYAN-ACETYLALANINEA1EKO0.83
AYAN-ACETYLALANINEB,D,F,H2V4I0.83
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.83
AYAN-ACETYLALANINEA,B,C,D1J4U0.83
C6LN-hexanoyl-L-homoserineA3DHA0.72
C6LN-hexanoyl-L-homoserineA3DHB0.72
OASO-ACETYLSERINEA,B,C,D,E,F,
G,H,I,J,K,L
2VAV0.78
OASO-ACETYLSERINEA2C580.78
OASO-ACETYLSERINEA1EBV0.78
OASO-ACETYLSERINEA,B,C,D,E,F,
G,H,I,J,K,L
2VAX0.78
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.74
AN0N-ACETYL-L-NORVALINEA1ZQ80.74
IPGN-ISOPROPYL GLYCINEC,D2SEM0.72
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.88
THCN-METHYLCARBONYLTHREONINEB2HR00.88
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.88
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.88
TH5O-acetyl-L-threonineA,D,E,F,G,H2VZK0.73
OLTO-METHYL-L-THREONINEA,B,C2AOC0.72
OLTO-METHYL-L-THREONINEA,B,C2AOD0.72
AACACETYLAMINO-ACETIC ACIDA,B1NG30.72
AACACETYLAMINO-ACETIC ACIDA1QD80.72
N10O-[(HEXYLAMINO)CARBONYL]-L-SERINEA,B,C,D,E,F,
G,H
2Q0S0.77
ALOALLO-THREONINEI,P1HDT0.71
ALOALLO-THREONINEA2JUU0.71
ALOALLO-THREONINEA2VMX0.71