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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00482467

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SIC(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-
1-yl]-3-sulfanylpropanoic acid
A,B3DIP0.71
IPGN-ISOPROPYL GLYCINEC,D2SEM0.71
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.8
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.8
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.72
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.73
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.77
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8V0.72
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2FVM0.72
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8H0.72
NXAN-CARBOXYALANINEA2IUX0.74
NXAN-CARBOXYALANINEA1O8A0.74
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.76
OGAN-OXALYOLGLYCINEA2RDS0.76
OGAN-OXALYOLGLYCINEA1H2M0.76
OGAN-OXALYOLGLYCINEA2QRL0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.76
OGAN-OXALYOLGLYCINEA2RDR0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.76
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.76
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.76
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.76
OGAN-OXALYOLGLYCINEA1H2K0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.76
OGAN-OXALYOLGLYCINEA,B2OQ70.76
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B,C,D,E,F,
G,H
1T6P0.75
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B1T6J0.75
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.72
SACN-ACETYL-SERINEA1R4U0.72
SACN-ACETYL-SERINEA,B,C,D1WS30.72
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.72
SACN-ACETYL-SERINEA,B1EVU0.72
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.72
SACN-ACETYL-SERINEA1WRR0.72
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.72
SACN-ACETYL-SERINEA,B3CVQ0.72
SACN-ACETYL-SERINEA1B0B0.72
SACN-ACETYL-SERINEA1XT40.72
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.72
SACN-ACETYL-SERINEA2FXL0.72
SACN-ACETYL-SERINEA1R4S0.72
SACN-ACETYL-SERINEA,B,C,D1WS20.72
SACN-ACETYL-SERINEA,B,C,D2AUC0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.72
SACN-ACETYL-SERINEA1R510.72
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.72
SACN-ACETYL-SERINEA,B,C,D1XXJ0.72
SACN-ACETYL-SERINET2QAC0.72
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.72
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.72
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.72
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.72
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.8
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.8
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.71
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.71
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.7
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.71
AYAN-ACETYLALANINEA1D0W0.79
AYAN-ACETYLALANINEA1AH40.79
AYAN-ACETYLALANINEA,B1VBP0.79
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.79
AYAN-ACETYLALANINEA,B,C,D1OUW0.79
AYAN-ACETYLALANINEA1AH30.79
AYAN-ACETYLALANINEA1EKO0.79
AYAN-ACETYLALANINEB,D,F,H2V4I0.79
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.79
AYAN-ACETYLALANINEA,B,C,D1J4U0.79
CL5N-(3-OXOPROPYL)GLYCINEA2IOT0.75
AACACETYLAMINO-ACETIC ACIDA,B1NG30.78
AACACETYLAMINO-ACETIC ACIDA1QD80.78
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.72
AN0N-ACETYL-L-NORVALINEA1ZQ80.72