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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03370593

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IPGN-ISOPROPYL GLYCINEC,D2SEM0.71
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.71
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.75
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.75
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.75
SACN-ACETYL-SERINEA1R4U0.75
SACN-ACETYL-SERINEA,B,C,D1WS30.75
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.75
SACN-ACETYL-SERINEA,B1EVU0.75
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.75
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.75
SACN-ACETYL-SERINEA1WRR0.75
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.75
SACN-ACETYL-SERINEA,B3CVQ0.75
SACN-ACETYL-SERINEA1B0B0.75
SACN-ACETYL-SERINEA1XT40.75
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.75
SACN-ACETYL-SERINEA2FXL0.75
SACN-ACETYL-SERINEA1R4S0.75
SACN-ACETYL-SERINEA,B,C,D1WS20.75
SACN-ACETYL-SERINEA,B,C,D2AUC0.75
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.75
SACN-ACETYL-SERINEA1R510.75
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.75
SACN-ACETYL-SERINEA,B,C,D1XXJ0.75
SACN-ACETYL-SERINET2QAC0.75
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.75
NXAN-CARBOXYALANINEA2IUX0.77
NXAN-CARBOXYALANINEA1O8A0.77
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.72
THCN-METHYLCARBONYLTHREONINEB2HR00.72
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.72
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.72
MAAN-METHYLALANINEA,B1A7Z0.73
MAAN-METHYLALANINEA,B2VSL0.73
MAAN-METHYLALANINEC1CWI0.73
MAAN-METHYLALANINEC,F,G,H3DW80.73
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.73
MAAN-METHYLALANINED1D5X0.73
MAAN-METHYLALANINEC1PYW0.73
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.73
MAAN-METHYLALANINEC,I2IE30.73
MAAN-METHYLALANINEC,F,X,Y2NPP0.73
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.74
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.74
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.74
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.75
AACACETYLAMINO-ACETIC ACIDA,B1NG30.71
AACACETYLAMINO-ACETIC ACIDA1QD80.71
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.71
AMEN-ACETYLMETHIONINEA,B2J4Y0.71
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.7
AYAN-ACETYLALANINEA1D0W0.82
AYAN-ACETYLALANINEA1AH40.82
AYAN-ACETYLALANINEA,B1VBP0.82
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.82
AYAN-ACETYLALANINEA,B,C,D1OUW0.82
AYAN-ACETYLALANINEA1AH30.82
AYAN-ACETYLALANINEA1EKO0.82
AYAN-ACETYLALANINEB,D,F,H2V4I0.82
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.82
AYAN-ACETYLALANINEA,B,C,D1J4U0.82
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.75
AN0N-ACETYL-L-NORVALINEA1ZQ80.75
NLGN-ACETYL-L-GLUTAMATEA1OH90.71
NLGN-ACETYL-L-GLUTAMATEA1OHA0.71
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.71
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.71
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.71
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.71
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.71
NLGN-ACETYL-L-GLUTAMATEA3B8G0.71
NLGN-ACETYL-L-GLUTAMATEA1GS50.71
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.71
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.72
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.72
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.72
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.76
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.71