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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00482748

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1ALALLANTOATE IONA,B,D,E,F,G,H2YZC0.7
1ALALLANTOATE IONA,B1Z2L0.7
SARSARCOSINEA,B173D0.73
SARSARCOSINEA,B1FJA0.73
SARSARCOSINEB3CYS0.73
SARSARCOSINEA,B,C1A7Y0.73
SARSARCOSINEA,B,C,D1I3W0.73
SARSARCOSINEA316D0.73
SARSARCOSINEC1IKF0.73
SARSARCOSINEA,M,N2Z6W0.73
SARSARCOSINEA,B,C1QFI0.73
SARSARCOSINEC1CWA0.73
SARSARCOSINEC1CWF0.73
SARSARCOSINEB,D,F,H,J,L,
N,P
1C5F0.73
SARSARCOSINEC1CWO0.73
SARSARCOSINED,E,F1XQ70.73
SARSARCOSINEC1CWL0.73
SARSARCOSINEA1CYA0.73
SARSARCOSINEA,B,D1MF80.73
SARSARCOSINEA,B1A7Z0.73
SARSARCOSINEB1MIK0.73
SARSARCOSINEA1CSA0.73
SARSARCOSINEC1CWM0.73
SARSARCOSINEA1DSC0.73
SARSARCOSINET,U,V2POY0.73
SARSARCOSINEA2D550.73
SARSARCOSINEC1BCK0.73
SARSARCOSINEA,B,D,E,F,H1M630.73
SARSARCOSINEC1CWC0.73
SARSARCOSINEC,D1QNH0.73
SARSARCOSINEB,D,F,H2RMC0.73
SARSARCOSINEC1CYN0.73
SARSARCOSINEC,D1MNV0.73
SARSARCOSINEC,D2OJU0.73
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMA0.73
SARSARCOSINEA1CYB0.73
SARSARCOSINED1QNG0.73
SARSARCOSINEC1CWB0.73
SARSARCOSINEA,B,C,D,E,F1UNM0.73
SARSARCOSINEA,B1OVF0.73
SARSARCOSINEA209D0.73
SARSARCOSINEA,B,C,D,E,F,
G,H
3BO70.73
SARSARCOSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.73
SARSARCOSINEA1DSD0.73
SARSARCOSINEB1L1V0.73
SARSARCOSINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.73
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMB0.73
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
YMA7,10,13-TRI(CARBOXYMETHYL)-5,15-
DIOXO-4,7,10,13,16-PENTAAZA-1,19-
DITHIANONADECANE
A1PY00.74
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.75
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.83
OGAN-OXALYOLGLYCINEA2RDS0.83
OGAN-OXALYOLGLYCINEA1H2M0.83
OGAN-OXALYOLGLYCINEA2QRL0.83
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.83
OGAN-OXALYOLGLYCINEA2RDR0.83
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.83
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.83
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.83
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.83
OGAN-OXALYOLGLYCINEA1H2K0.83
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.83
OGAN-OXALYOLGLYCINEA,B2OQ70.83
BZPN1-CARBOXYPIPERAZINEA,D1OKK0.71
BZPN1-CARBOXYPIPERAZINEA1MEM0.71
CMSCARBAMOYL SARCOSINEA,B1CHM0.75
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.71
AN0N-ACETYL-L-NORVALINEA1ZQ80.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.7
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.87
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.87
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.73
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.73
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.73
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
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.71
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1U6R0.71
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA1RL90.71
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1VRP0.71
NXAN-CARBOXYALANINEA2IUX0.76
NXAN-CARBOXYALANINEA1O8A0.76
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A2AXN0.71
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A1NNF0.71
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A,B1ZLQ0.71
IPGN-ISOPROPYL GLYCINEC,D2SEM0.77
AACACETYLAMINO-ACETIC ACIDA,B1NG30.89
AACACETYLAMINO-ACETIC ACIDA1QD80.89
CR5(2R)-2-(AMINOMETHYL)-2,4-DIHYDROXY-
5-OXO-3-(2-OXOETHYL)-2,5-DIHYDRO-
1H-IMIDAZOL-3-IUM
A1QYQ0.71
MAAN-METHYLALANINEA,B1A7Z0.71
MAAN-METHYLALANINEA,B2VSL0.71
MAAN-METHYLALANINEC1CWI0.71
MAAN-METHYLALANINEC,F,G,H3DW80.71
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.71
MAAN-METHYLALANINED1D5X0.71
MAAN-METHYLALANINEC1PYW0.71
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.71
MAAN-METHYLALANINEC,I2IE30.71
MAAN-METHYLALANINEC,F,X,Y2NPP0.71