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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813419

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.77
HSEL-HOMOSERINEA2VDJ0.75
HSEL-HOMOSERINEA,B,C,D1EBU0.75
HSEL-HOMOSERINEA,C1J9N0.75
HSEL-HOMOSERINEA1PQP0.75
HSEL-HOMOSERINEC1H720.75
HSEL-HOMOSERINEE,F3DKS0.75
NXAN-CARBOXYALANINEA2IUX0.72
NXAN-CARBOXYALANINEA1O8A0.72
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.71
DSEN-METHYL-D-SERINEC1CWH0.7
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.72
AMEN-ACETYLMETHIONINEA,B2J4Y0.72
C6LN-hexanoyl-L-homoserineA3DHA0.83
C6LN-hexanoyl-L-homoserineA3DHB0.83
UN22-AMINO-4,4-DIHYDROXYBUTANOIC ACIDA,B,C,D1H0G0.74
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.71
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.7
AYAN-ACETYLALANINEA1D0W0.77
AYAN-ACETYLALANINEA1AH40.77
AYAN-ACETYLALANINEA,B1VBP0.77
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.77
AYAN-ACETYLALANINEA,B,C,D1OUW0.77
AYAN-ACETYLALANINEA1AH30.77
AYAN-ACETYLALANINEA1EKO0.77
AYAN-ACETYLALANINEB,D,F,H2V4I0.77
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.77
AYAN-ACETYLALANINEA,B,C,D1J4U0.77
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.71
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.71
OGAN-OXALYOLGLYCINEA2RDS0.71
OGAN-OXALYOLGLYCINEA1H2M0.71
OGAN-OXALYOLGLYCINEA2QRL0.71
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.71
OGAN-OXALYOLGLYCINEA2RDR0.71
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.71
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.71
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.71
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.71
OGAN-OXALYOLGLYCINEA1H2K0.71
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.71
OGAN-OXALYOLGLYCINEA,B2OQ70.71
NSKN-SUCCINYL LYSINEA2P8B0.7
NLGN-ACETYL-L-GLUTAMATEA1OH90.73
NLGN-ACETYL-L-GLUTAMATEA1OHA0.73
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.73
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.73
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.73
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.73
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.73
NLGN-ACETYL-L-GLUTAMATEA3B8G0.73
NLGN-ACETYL-L-GLUTAMATEA1GS50.73
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.73
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.72
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
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.7
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.8
SACN-ACETYL-SERINEA1R4U0.8
SACN-ACETYL-SERINEA,B,C,D1WS30.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.8
SACN-ACETYL-SERINEA,B1EVU0.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.8
SACN-ACETYL-SERINEA1WRR0.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.8
SACN-ACETYL-SERINEA,B3CVQ0.8
SACN-ACETYL-SERINEA1B0B0.8
SACN-ACETYL-SERINEA1XT40.8
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.8
SACN-ACETYL-SERINEA2FXL0.8
SACN-ACETYL-SERINEA1R4S0.8
SACN-ACETYL-SERINEA,B,C,D1WS20.8
SACN-ACETYL-SERINEA,B,C,D2AUC0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.8
SACN-ACETYL-SERINEA1R510.8
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.8
SACN-ACETYL-SERINEA,B,C,D1XXJ0.8
SACN-ACETYL-SERINET2QAC0.8
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.8
CANCANALINEA,B,C2CAN0.71
HYP4-HYDROXYPROLINEA1OB40.72
HYP4-HYDROXYPROLINEA,B,C1QSU0.72
HYP4-HYDROXYPROLINEA,C,E,G,I,K,
M,O
1GK80.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.72
HYP4-HYDROXYPROLINEE,F,G,H,I,J2F6A0.72
HYP4-HYDROXYPROLINEA1TCH0.72
HYP4-HYDROXYPROLINEA1KCP0.72
HYP4-HYDROXYPROLINEA2JTU0.72
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M1K830.72
HYP4-HYDROXYPROLINEA3E2Q0.72
HYP4-HYDROXYPROLINEA1TR60.72
HYP4-HYDROXYPROLINEA1P1P0.72
HYP4-HYDROXYPROLINEB,C,E,F,H,I,
K,L,M,N,O,P,
Q,R,S,T
2HOD0.72
HYP4-HYDROXYPROLINEA,B,C,D2V530.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.72
HYP4-HYDROXYPROLINEA2VUV0.72
HYP4-HYDROXYPROLINEA1EYO0.72
HYP4-HYDROXYPROLINED,H2FES0.72
HYP4-HYDROXYPROLINEA,B,E,F3EJH0.72
HYP4-HYDROXYPROLINEA2JQB0.72
HYP4-HYDROXYPROLINEA2P4L0.72
HYP4-HYDROXYPROLINEA2H9X0.72
HYP4-HYDROXYPROLINEA1AV30.72
HYP4-HYDROXYPROLINEA1TCJ0.72
HYP4-HYDROXYPROLINEA2IHA0.72
HYP4-HYDROXYPROLINEA,B,C1BKV0.72
HYP4-HYDROXYPROLINEA1R9U0.72
HYP4-HYDROXYPROLINEA1AG70.72
HYP4-HYDROXYPROLINEA1GQ00.72
HYP4-HYDROXYPROLINEA1R9I0.72
HYP4-HYDROXYPROLINEH1LM80.72
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F1EI80.72
HYP4-HYDROXYPROLINEA,B,C1Q7D0.72
HYP4-HYDROXYPROLINEA1VIB0.72
HYP4-HYDROXYPROLINED,H2FEQ0.72
HYP4-HYDROXYPROLINEA1DG00.72
HYP4-HYDROXYPROLINEB,C,D,F1DZI0.72
HYP4-HYDROXYPROLINEA1GIB0.72
HYP4-HYDROXYPROLINEA,D1LQB0.72
HYP4-HYDROXYPROLINEA,B,C3DMW0.72
HYP4-HYDROXYPROLINEA2JQC0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F1X1K0.72
HYP4-HYDROXYPROLINEA1IEO0.72
HYP4-HYDROXYPROLINED,H1NZQ0.72
HYP4-HYDROXYPROLINEA2JRY0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.72
HYP4-HYDROXYPROLINEA,B1JOH0.72
HYP4-HYDROXYPROLINEA1PQR0.72
HYP4-HYDROXYPROLINEA1TTL0.72
HYP4-HYDROXYPROLINEA2B5Q0.72
HYP4-HYDROXYPROLINEA,B,C1CAG0.72
HYP4-HYDROXYPROLINEA2EW40.72
HYP4-HYDROXYPROLINEB,C,E,F,G,H2HLO0.72
HYP4-HYDROXYPROLINEA2YYF0.72
HYP4-HYDROXYPROLINEA1G1P0.72
HYP4-HYDROXYPROLINEA,B,D,E,H,K,
O,R,V
1UWA0.72
HYP4-HYDROXYPROLINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.72
HYP4-HYDROXYPROLINEA2VUZ0.72
HYP4-HYDROXYPROLINEA1QFB0.72
HYP4-HYDROXYPROLINED,H1O0D0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3F0.72
HYP4-HYDROXYPROLINEA2J150.72
HYP4-HYDROXYPROLINEA1DFZ0.72
HYP4-HYDROXYPROLINEA,B1OB60.72
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M3CQZ0.72
HYP4-HYDROXYPROLINE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.72
HYP4-HYDROXYPROLINEA1TCK0.72
HYP4-HYDROXYPROLINEA1G1Z0.72
HYP4-HYDROXYPROLINEA,B,D,E,F,G1YM80.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.72
HYP4-HYDROXYPROLINEA1MTQ0.72
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.72
HYP4-HYDROXYPROLINEA,B,C1V7H0.72
HYP4-HYDROXYPROLINEA,B,G2G660.72
HYP4-HYDROXYPROLINEA1OB70.72
HYP4-HYDROXYPROLINEA1OMC0.72
HYP4-HYDROXYPROLINEX2HCZ0.72
HYP4-HYDROXYPROLINEA1DFY0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3H0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.72
HYP4-HYDROXYPROLINEA1IH90.72
HYP4-HYDROXYPROLINEA2IH60.72
HYP4-HYDROXYPROLINEA2IH70.72
HYP4-HYDROXYPROLINEA1JLP0.72
HYP4-HYDROXYPROLINEA,C,E,F2W650.72
HYP4-HYDROXYPROLINEA1AS50.72
HYP4-HYDROXYPROLINEA,B,C1V6Q0.72
HYP4-HYDROXYPROLINEA,B,C1V4F0.72
HYP4-HYDROXYPROLINEA,B,C1Y0F0.72
HYP4-HYDROXYPROLINEA,B,C2DRX0.72
HYP4-HYDROXYPROLINEA1K640.72
HYP4-HYDROXYPROLINEA,B,C1YGV0.72
HYP4-HYDROXYPROLINEA2B5P0.72
HYP4-HYDROXYPROLINEA,B,C2DRT0.72
HYP4-HYDROXYPROLINEA2CCO0.72
HYP4-HYDROXYPROLINEA1WCT0.72
HYP4-HYDROXYPROLINEA1D7T0.72
HYP4-HYDROXYPROLINEA1JLO0.72
HYP4-HYDROXYPROLINEA,B,C1CGD0.72
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.72
HYP4-HYDROXYPROLINEH,P2A2X0.72
HYP4-HYDROXYPROLINEA1DLZ0.72
HYP4-HYDROXYPROLINEA,B,C,I,J,L,
M,T
2VUM0.72
HYP4-HYDROXYPROLINEA1TCG0.72
HYP4-HYDROXYPROLINEH,P2ANK0.72
HYP4-HYDROXYPROLINEA,B,C1WZB0.72
HYP4-HYDROXYPROLINEA1BDK0.72
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.72
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.7
PAUPANTOTHENOIC ACIDA,B2F9W0.74
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.74
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.74
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.74
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.71
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA2OXK0.72
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA,B,C2OXJ0.72
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA1J8N0.72
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.73
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.82
THCN-METHYLCARBONYLTHREONINEB2HR00.82
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.82
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.82
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.79
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.79
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.79
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.79
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.77
AN0N-ACETYL-L-NORVALINEA1ZQ80.77