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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813420

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HSEL-HOMOSERINEA2VDJ0.73
HSEL-HOMOSERINEA,B,C,D1EBU0.73
HSEL-HOMOSERINEA,C1J9N0.73
HSEL-HOMOSERINEA1PQP0.73
HSEL-HOMOSERINEC1H720.73
HSEL-HOMOSERINEE,F3DKS0.73
AYAN-ACETYLALANINEA1D0W0.75
AYAN-ACETYLALANINEA1AH40.75
AYAN-ACETYLALANINEA,B1VBP0.75
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.75
AYAN-ACETYLALANINEA,B,C,D1OUW0.75
AYAN-ACETYLALANINEA1AH30.75
AYAN-ACETYLALANINEA1EKO0.75
AYAN-ACETYLALANINEB,D,F,H2V4I0.75
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.75
AYAN-ACETYLALANINEA,B,C,D1J4U0.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.74
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.74
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.74
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.74
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.74
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.74
HYP4-HYDROXYPROLINEA1OB40.71
HYP4-HYDROXYPROLINEA,B,C1QSU0.71
HYP4-HYDROXYPROLINEA,C,E,G,I,K,
M,O
1GK80.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.71
HYP4-HYDROXYPROLINEE,F,G,H,I,J2F6A0.71
HYP4-HYDROXYPROLINEA1TCH0.71
HYP4-HYDROXYPROLINEA1KCP0.71
HYP4-HYDROXYPROLINEA2JTU0.71
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M1K830.71
HYP4-HYDROXYPROLINEA3E2Q0.71
HYP4-HYDROXYPROLINEA1TR60.71
HYP4-HYDROXYPROLINEA1P1P0.71
HYP4-HYDROXYPROLINEB,C,E,F,H,I,
K,L,M,N,O,P,
Q,R,S,T
2HOD0.71
HYP4-HYDROXYPROLINEA,B,C,D2V530.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.71
HYP4-HYDROXYPROLINEA2VUV0.71
HYP4-HYDROXYPROLINEA1EYO0.71
HYP4-HYDROXYPROLINED,H2FES0.71
HYP4-HYDROXYPROLINEA,B,E,F3EJH0.71
HYP4-HYDROXYPROLINEA2JQB0.71
HYP4-HYDROXYPROLINEA2P4L0.71
HYP4-HYDROXYPROLINEA2H9X0.71
HYP4-HYDROXYPROLINEA1AV30.71
HYP4-HYDROXYPROLINEA1TCJ0.71
HYP4-HYDROXYPROLINEA2IHA0.71
HYP4-HYDROXYPROLINEA,B,C1BKV0.71
HYP4-HYDROXYPROLINEA1R9U0.71
HYP4-HYDROXYPROLINEA1AG70.71
HYP4-HYDROXYPROLINEA1GQ00.71
HYP4-HYDROXYPROLINEA1R9I0.71
HYP4-HYDROXYPROLINEH1LM80.71
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F1EI80.71
HYP4-HYDROXYPROLINEA,B,C1Q7D0.71
HYP4-HYDROXYPROLINEA1VIB0.71
HYP4-HYDROXYPROLINED,H2FEQ0.71
HYP4-HYDROXYPROLINEA1DG00.71
HYP4-HYDROXYPROLINEB,C,D,F1DZI0.71
HYP4-HYDROXYPROLINEA1GIB0.71
HYP4-HYDROXYPROLINEA,D1LQB0.71
HYP4-HYDROXYPROLINEA,B,C3DMW0.71
HYP4-HYDROXYPROLINEA2JQC0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F1X1K0.71
HYP4-HYDROXYPROLINEA1IEO0.71
HYP4-HYDROXYPROLINED,H1NZQ0.71
HYP4-HYDROXYPROLINEA2JRY0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.71
HYP4-HYDROXYPROLINEA,B1JOH0.71
HYP4-HYDROXYPROLINEA1PQR0.71
HYP4-HYDROXYPROLINEA1TTL0.71
HYP4-HYDROXYPROLINEA2B5Q0.71
HYP4-HYDROXYPROLINEA,B,C1CAG0.71
HYP4-HYDROXYPROLINEA2EW40.71
HYP4-HYDROXYPROLINEB,C,E,F,G,H2HLO0.71
HYP4-HYDROXYPROLINEA2YYF0.71
HYP4-HYDROXYPROLINEA1G1P0.71
HYP4-HYDROXYPROLINEA,B,D,E,H,K,
O,R,V
1UWA0.71
HYP4-HYDROXYPROLINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.71
HYP4-HYDROXYPROLINEA2VUZ0.71
HYP4-HYDROXYPROLINEA1QFB0.71
HYP4-HYDROXYPROLINED,H1O0D0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3F0.71
HYP4-HYDROXYPROLINEA2J150.71
HYP4-HYDROXYPROLINEA1DFZ0.71
HYP4-HYDROXYPROLINEA,B1OB60.71
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M3CQZ0.71
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
1IR20.71
HYP4-HYDROXYPROLINEA1TCK0.71
HYP4-HYDROXYPROLINEA1G1Z0.71
HYP4-HYDROXYPROLINEA,B,D,E,F,G1YM80.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.71
HYP4-HYDROXYPROLINEA1MTQ0.71
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.71
HYP4-HYDROXYPROLINEA,B,C1V7H0.71
HYP4-HYDROXYPROLINEA,B,G2G660.71
HYP4-HYDROXYPROLINEA1OB70.71
HYP4-HYDROXYPROLINEA1OMC0.71
HYP4-HYDROXYPROLINEX2HCZ0.71
HYP4-HYDROXYPROLINEA1DFY0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3H0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.71
HYP4-HYDROXYPROLINEA1IH90.71
HYP4-HYDROXYPROLINEA2IH60.71
HYP4-HYDROXYPROLINEA2IH70.71
HYP4-HYDROXYPROLINEA1JLP0.71
HYP4-HYDROXYPROLINEA,C,E,F2W650.71
HYP4-HYDROXYPROLINEA1AS50.71
HYP4-HYDROXYPROLINEA,B,C1V6Q0.71
HYP4-HYDROXYPROLINEA,B,C1V4F0.71
HYP4-HYDROXYPROLINEA,B,C1Y0F0.71
HYP4-HYDROXYPROLINEA,B,C2DRX0.71
HYP4-HYDROXYPROLINEA1K640.71
HYP4-HYDROXYPROLINEA,B,C1YGV0.71
HYP4-HYDROXYPROLINEA2B5P0.71
HYP4-HYDROXYPROLINEA,B,C2DRT0.71
HYP4-HYDROXYPROLINEA2CCO0.71
HYP4-HYDROXYPROLINEA1WCT0.71
HYP4-HYDROXYPROLINEA1D7T0.71
HYP4-HYDROXYPROLINEA1JLO0.71
HYP4-HYDROXYPROLINEA,B,C1CGD0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.71
HYP4-HYDROXYPROLINEH,P2A2X0.71
HYP4-HYDROXYPROLINEA1DLZ0.71
HYP4-HYDROXYPROLINEA,B,C,I,J,L,
M,T
2VUM0.71
HYP4-HYDROXYPROLINEA1TCG0.71
HYP4-HYDROXYPROLINEH,P2ANK0.71
HYP4-HYDROXYPROLINEA,B,C1WZB0.71
HYP4-HYDROXYPROLINEA1BDK0.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.71
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.78
SACN-ACETYL-SERINEA1R4U0.78
SACN-ACETYL-SERINEA,B,C,D1WS30.78
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.78
SACN-ACETYL-SERINEA,B1EVU0.78
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.78
SACN-ACETYL-SERINEA1WRR0.78
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.78
SACN-ACETYL-SERINEA,B3CVQ0.78
SACN-ACETYL-SERINEA1B0B0.78
SACN-ACETYL-SERINEA1XT40.78
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.78
SACN-ACETYL-SERINEA2FXL0.78
SACN-ACETYL-SERINEA1R4S0.78
SACN-ACETYL-SERINEA,B,C,D1WS20.78
SACN-ACETYL-SERINEA,B,C,D2AUC0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.78
SACN-ACETYL-SERINEA1R510.78
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.78
SACN-ACETYL-SERINEA,B,C,D1XXJ0.78
SACN-ACETYL-SERINET2QAC0.78
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.78
NXAN-CARBOXYALANINEA2IUX0.74
NXAN-CARBOXYALANINEA1O8A0.74
C6LN-hexanoyl-L-homoserineA3DHA0.82
C6LN-hexanoyl-L-homoserineA3DHB0.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.77
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.77
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.77
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.77
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.77
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.77
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.77
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.77
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.77
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.77
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.71
AMEN-ACETYLMETHIONINEA,B2J4Y0.71
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.73
OGAN-OXALYOLGLYCINEA2RDS0.73
OGAN-OXALYOLGLYCINEA1H2M0.73
OGAN-OXALYOLGLYCINEA2QRL0.73
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.73
OGAN-OXALYOLGLYCINEA2RDR0.73
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.73
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.73
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.73
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.73
OGAN-OXALYOLGLYCINEA1H2K0.73
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.73
OGAN-OXALYOLGLYCINEA,B2OQ70.73
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.75
AN0N-ACETYL-L-NORVALINEA1ZQ80.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.76
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
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
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.71
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.74
PAUPANTOTHENOIC ACIDA,B2F9W0.72
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.72
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.72
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.72
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA2OXK0.7
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA,B,C2OXJ0.7
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA1J8N0.7