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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01782098

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
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.72
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.72
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.93
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.93
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.93
SACN-ACETYL-SERINEA1R4U0.93
SACN-ACETYL-SERINEA,B,C,D1WS30.93
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.93
SACN-ACETYL-SERINEA,B1EVU0.93
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.93
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.93
SACN-ACETYL-SERINEA1WRR0.93
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.93
SACN-ACETYL-SERINEA,B3CVQ0.93
SACN-ACETYL-SERINEA1B0B0.93
SACN-ACETYL-SERINEA1XT40.93
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.93
SACN-ACETYL-SERINEA2FXL0.93
SACN-ACETYL-SERINEA1R4S0.93
SACN-ACETYL-SERINEA,B,C,D1WS20.93
SACN-ACETYL-SERINEA,B,C,D2AUC0.93
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.93
SACN-ACETYL-SERINEA1R510.93
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.93
SACN-ACETYL-SERINEA,B,C,D1XXJ0.93
SACN-ACETYL-SERINET2QAC0.93
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.93
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.71
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.71
C99{(2R)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]-
2-HYDROXY-4,5-DIOXOIMIDAZOLIDIN-
1-YL}ACETIC ACID
A2HCG0.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.71
AN0N-ACETYL-L-NORVALINEA1ZQ80.71
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B800.7
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B7V0.7
N10O-[(HEXYLAMINO)CARBONYL]-L-SERINEA,B,C,D,E,F,
G,H
2Q0S0.71
NXAN-CARBOXYALANINEA2IUX0.75
NXAN-CARBOXYALANINEA1O8A0.75
SVASERINE VANADATEA,B1B8J0.7
OLZO-(2-aminoethyl)-L-serineA3DJ00.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.71
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.71
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.71
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
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.7
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.71
SETAMINOSERINEA,B1D5E0.71
SETAMINOSERINEA1JD80.71
SETAMINOSERINEA1JC80.71
SETAMINOSERINEA,B,C1A7C0.71
SETAMINOSERINEA,B1D5H0.71
SETAMINOSERINEA1JAA0.71
SETAMINOSERINEA1JCP0.71
SETAMINOSERINEA,B1D5D0.71
AYAN-ACETYLALANINEA1D0W0.8
AYAN-ACETYLALANINEA1AH40.8
AYAN-ACETYLALANINEA,B1VBP0.8
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.8
AYAN-ACETYLALANINEA,B,C,D1OUW0.8
AYAN-ACETYLALANINEA1AH30.8
AYAN-ACETYLALANINEA1EKO0.8
AYAN-ACETYLALANINEB,D,F,H2V4I0.8
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.8
AYAN-ACETYLALANINEA,B,C,D1J4U0.8
DSEN-METHYL-D-SERINEC1CWH0.82
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.71
MAAN-METHYLALANINEA,B1A7Z0.71
MAAN-METHYLALANINEA,B2VSL0.71
MAAN-METHYLALANINEC1CWI0.71
MAAN-METHYLALANINEC,F,G,H3DW80.71
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.71
MAAN-METHYLALANINED1D5X0.71
MAAN-METHYLALANINEC1PYW0.71
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.71
MAAN-METHYLALANINEC,I2IE30.71
MAAN-METHYLALANINEC,F,X,Y2NPP0.71