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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206824

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.75
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.75
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.75
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.75
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.75
SYS3-[(2-amino-2-oxoethyl)selanyl]-
L-alanine
A,B,C,D3BOG0.71
MAAN-METHYLALANINEA,B1A7Z0.74
MAAN-METHYLALANINEA,B2VSL0.74
MAAN-METHYLALANINEC1CWI0.74
MAAN-METHYLALANINEC,F,G,H3DW80.74
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.74
MAAN-METHYLALANINED1D5X0.74
MAAN-METHYLALANINEC1PYW0.74
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.74
MAAN-METHYLALANINEC,I2IE30.74
MAAN-METHYLALANINEC,F,X,Y2NPP0.74
DNP3-AMINO-ALANINEA1BEI0.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.75
NXAN-CARBOXYALANINEA2IUX0.78
NXAN-CARBOXYALANINEA1O8A0.78
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.7
THCN-METHYLCARBONYLTHREONINEB2HR00.7
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.7
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.7
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B,C,D,E,F,
G,H
1T6P0.7
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B1T6J0.7
DPPDIAMMINOPROPANOIC ACIDA,B1B5H0.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.71
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.77
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.73
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.75
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.75
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.75
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.75
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.73
AN0N-ACETYL-L-NORVALINEA1ZQ80.73
AYAN-ACETYLALANINEA1D0W0.83
AYAN-ACETYLALANINEA1AH40.83
AYAN-ACETYLALANINEA,B1VBP0.83
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.83
AYAN-ACETYLALANINEA,B,C,D1OUW0.83
AYAN-ACETYLALANINEA1AH30.83
AYAN-ACETYLALANINEA1EKO0.83
AYAN-ACETYLALANINEB,D,F,H2V4I0.83
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.83
AYAN-ACETYLALANINEA,B,C,D1J4U0.83
IPGN-ISOPROPYL GLYCINEC,D2SEM0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.71
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.74
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.74
HION-HYDROXY-N-ISOPROPYLOXAMIC ACIDI,J,K,L1YVE0.71
AACACETYLAMINO-ACETIC ACIDA,B1NG30.72
AACACETYLAMINO-ACETIC ACIDA1QD80.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.76
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.76
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.76
SACN-ACETYL-SERINEA1R4U0.76
SACN-ACETYL-SERINEA,B,C,D1WS30.76
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.76
SACN-ACETYL-SERINEA,B1EVU0.76
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.76
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.76
SACN-ACETYL-SERINEA1WRR0.76
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.76
SACN-ACETYL-SERINEA,B3CVQ0.76
SACN-ACETYL-SERINEA1B0B0.76
SACN-ACETYL-SERINEA1XT40.76
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.76
SACN-ACETYL-SERINEA2FXL0.76
SACN-ACETYL-SERINEA1R4S0.76
SACN-ACETYL-SERINEA,B,C,D1WS20.76
SACN-ACETYL-SERINEA,B,C,D2AUC0.76
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.76
SACN-ACETYL-SERINEA1R510.76
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.76
SACN-ACETYL-SERINEA,B,C,D1XXJ0.76
SACN-ACETYL-SERINET2QAC0.76
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.77
OGAN-OXALYOLGLYCINEA2RDS0.77
OGAN-OXALYOLGLYCINEA1H2M0.77
OGAN-OXALYOLGLYCINEA2QRL0.77
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.77
OGAN-OXALYOLGLYCINEA2RDR0.77
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.77
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.77
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.77
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.77
OGAN-OXALYOLGLYCINEA1H2K0.77
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.77
OGAN-OXALYOLGLYCINEA,B2OQ70.77
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.72