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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02313863

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MAAN-METHYLALANINEA,B1A7Z0.84
MAAN-METHYLALANINEA,B2VSL0.84
MAAN-METHYLALANINEC1CWI0.84
MAAN-METHYLALANINEC,F,G,H3DW80.84
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.84
MAAN-METHYLALANINED1D5X0.84
MAAN-METHYLALANINEC1PYW0.84
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.84
MAAN-METHYLALANINEC,I2IE30.84
MAAN-METHYLALANINEC,F,X,Y2NPP0.84
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.72
MLEN-METHYLLEUCINEA,D2J9A0.73
MLEN-METHYLLEUCINEC1IKF0.73
MLEN-METHYLLEUCINEA,M,N2Z6W0.73
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.73
MLEN-METHYLLEUCINED,E,F1XQ70.73
MLEN-METHYLLEUCINEC1CWA0.73
MLEN-METHYLLEUCINEC1CWF0.73
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.73
MLEN-METHYLLEUCINEB3CYS0.73
MLEN-METHYLLEUCINEC1CWH0.73
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.73
MLEN-METHYLLEUCINEC1CYN0.73
MLEN-METHYLLEUCINEA1LV90.73
MLEN-METHYLLEUCINEC,D2OJU0.73
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.73
MLEN-METHYLLEUCINEA1IKM0.73
MLEN-METHYLLEUCINEC1CWK0.73
MLEN-METHYLLEUCINEA,B2HG80.73
MLEN-METHYLLEUCINEC1CWB0.73
MLEN-METHYLLEUCINEC1CWJ0.73
MLEN-METHYLLEUCINEA1CYB0.73
MLEN-METHYLLEUCINED1QNG0.73
MLEN-METHYLLEUCINEB1MIK0.73
MLEN-METHYLLEUCINEA1CSA0.73
MLEN-METHYLLEUCINEC1CWL0.73
MLEN-METHYLLEUCINEA1CYA0.73
MLEN-METHYLLEUCINEA,B,D1MF80.73
MLEN-METHYLLEUCINEC1BCK0.73
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.73
MLEN-METHYLLEUCINEC1CWC0.73
MLEN-METHYLLEUCINEC1CWI0.73
MLEN-METHYLLEUCINEC,D1QNH0.73
MLEN-METHYLLEUCINEB,D,F,H2RMC0.73
MLEN-METHYLLEUCINEC1CWM0.73
MLEN-METHYLLEUCINET,U,V2POY0.73
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.73
MLEN-METHYLLEUCINEC1CWO0.73
MLEN-METHYLLEUCINEA1IKL0.73
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.72
MVAN-METHYLVALINEA209D0.77
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H
3BO70.77
MVAN-METHYLVALINEC1CWH0.77
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
1UNJ0.77
MVAN-METHYLVALINEA1DSD0.77
MVAN-METHYLVALINEB1L1V0.77
MVAN-METHYLVALINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.77
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMB0.77
MVAN-METHYLVALINEC1CWO0.77
MVAN-METHYLVALINEC1CWL0.77
MVAN-METHYLVALINEB1MIK0.77
MVAN-METHYLVALINEA1CSA0.77
MVAN-METHYLVALINEC1CWM0.77
MVAN-METHYLVALINEA1PFE0.77
MVAN-METHYLVALINEA,B,D,E,F,H1M630.77
MVAN-METHYLVALINEC1CWC0.77
MVAN-METHYLVALINEB,D,F,H2RMC0.77
MVAN-METHYLVALINEC1CWK0.77
MVAN-METHYLVALINEC1CYN0.77
MVAN-METHYLVALINEC,D1MNV0.77
MVAN-METHYLVALINEC,D2OJU0.77
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMA0.77
MVAN-METHYLVALINEA1CYB0.77
MVAN-METHYLVALINED1QNG0.77
MVAN-METHYLVALINEA,C,E,G2ADW0.77
MVAN-METHYLVALINEC1CWB0.77
MVAN-METHYLVALINEA,B,C,D,E,F1UNM0.77
MVAN-METHYLVALINEA,B1OVF0.77
MVAN-METHYLVALINEA,B185D0.77
MVAN-METHYLVALINEA1XVK0.77
MVAN-METHYLVALINEA,C1XVR0.77
MVAN-METHYLVALINEA,B173D0.77
MVAN-METHYLVALINEA,B1FJA0.77
MVAN-METHYLVALINEB3CYS0.77
MVAN-METHYLVALINEA,B,C1A7Y0.77
MVAN-METHYLVALINEA,B,C1L5G0.77
MVAN-METHYLVALINEA,B,C,D1I3W0.77
MVAN-METHYLVALINEA316D0.77
MVAN-METHYLVALINEA1XVN0.77
MVAN-METHYLVALINEC1IKF0.77
MVAN-METHYLVALINEA,M,N2Z6W0.77
MVAN-METHYLVALINEA,B,C1QFI0.77
MVAN-METHYLVALINEA,B3GO30.77
MVAN-METHYLVALINEC1CWA0.77
MVAN-METHYLVALINEC1CWF0.77
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P
1C5F0.77
MVAN-METHYLVALINED,E,F1XQ70.77
MVAN-METHYLVALINEA1CYA0.77
MVAN-METHYLVALINEA,B,D1MF80.77
MVAN-METHYLVALINEA,B1A7Z0.77
MVAN-METHYLVALINEA1DSC0.77
MVAN-METHYLVALINET,U,V2POY0.77
MVAN-METHYLVALINEA2D550.77
MVAN-METHYLVALINEC1BCK0.77
MVAN-METHYLVALINEC1CWI0.77
MVAN-METHYLVALINEC,D1QNH0.77
MVAN-METHYLVALINEA1VS20.77
NMCN-CYCLOPROPYLMETHYL GLYCINEC,D3SEM0.88
CL5N-(3-OXOPROPYL)GLYCINEA2IOT0.82
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1U6R0.75
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA1RL90.75
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1VRP0.75
IPGN-ISOPROPYL GLYCINEC,D2SEM0.9
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.73
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.73
DNMN-METHYL-D-NORLEUCINEA1R9V0.73
NXAN-CARBOXYALANINEA2IUX0.73
NXAN-CARBOXYALANINEA1O8A0.73
AACACETYLAMINO-ACETIC ACIDA,B1NG30.81
AACACETYLAMINO-ACETIC ACIDA1QD80.81
DMGN,N-DIMETHYLGLYCINEA,B,C,D1VRQ0.75
DMGN,N-DIMETHYLGLYCINEA,B,C,D1X310.75
DMGN,N-DIMETHYLGLYCINEA,B,C1XKP0.75
DMGN,N-DIMETHYLGLYCINEA,B1EL50.75
DSEN-METHYL-D-SERINEC1CWH0.73
BETTRIMETHYL GLYCINEA1RCC0.75
BETTRIMETHYL GLYCINEA,B3DSB0.75
BETTRIMETHYL GLYCINEA1RCI0.75
BETTRIMETHYL GLYCINEA1SW20.75
BETTRIMETHYL GLYCINEA1RCE0.75
BETTRIMETHYL GLYCINEA1R9L0.75
BETTRIMETHYL GLYCINEA1RCD0.75
BETTRIMETHYL GLYCINEA,B,C2WIT0.75
BETTRIMETHYL GLYCINEA2B4L0.75
BETTRIMETHYL GLYCINEA1RCG0.75
BETTRIMETHYL GLYCINEA,B,C,D1WWJ0.75
IMLN-METHYL-ISOLEUCINEC1CWM0.73
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.75
AN0N-ACETYL-L-NORVALINEA1ZQ80.75
SARSARCOSINEA,B173D0.82
SARSARCOSINEA,B1FJA0.82
SARSARCOSINEB3CYS0.82
SARSARCOSINEA,B,C1A7Y0.82
SARSARCOSINEA,B,C,D1I3W0.82
SARSARCOSINEA316D0.82
SARSARCOSINEC1IKF0.82
SARSARCOSINEA,M,N2Z6W0.82
SARSARCOSINEA,B,C1QFI0.82
SARSARCOSINEC1CWA0.82
SARSARCOSINEC1CWF0.82
SARSARCOSINEB,D,F,H,J,L,
N,P
1C5F0.82
SARSARCOSINEC1CWO0.82
SARSARCOSINED,E,F1XQ70.82
SARSARCOSINEC1CWL0.82
SARSARCOSINEA1CYA0.82
SARSARCOSINEA,B,D1MF80.82
SARSARCOSINEA,B1A7Z0.82
SARSARCOSINEB1MIK0.82
SARSARCOSINEA1CSA0.82
SARSARCOSINEC1CWM0.82
SARSARCOSINEA1DSC0.82
SARSARCOSINET,U,V2POY0.82
SARSARCOSINEA2D550.82
SARSARCOSINEC1BCK0.82
SARSARCOSINEA,B,D,E,F,H1M630.82
SARSARCOSINEC1CWC0.82
SARSARCOSINEC,D1QNH0.82
SARSARCOSINEB,D,F,H2RMC0.82
SARSARCOSINEC1CYN0.82
SARSARCOSINEC,D1MNV0.82
SARSARCOSINEC,D2OJU0.82
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMA0.82
SARSARCOSINEA1CYB0.82
SARSARCOSINED1QNG0.82
SARSARCOSINEC1CWB0.82
SARSARCOSINEA,B,C,D,E,F1UNM0.82
SARSARCOSINEA,B1OVF0.82
SARSARCOSINEA209D0.82
SARSARCOSINEA,B,C,D,E,F,
G,H
3BO70.82
SARSARCOSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.82
SARSARCOSINEA1DSD0.82
SARSARCOSINEB1L1V0.82
SARSARCOSINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.82
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMB0.82
DPRD-PROLINEP1MCB0.7
DPRD-PROLINEA,B,C,H,K,L2R5B0.7
DPRD-PROLINEA2KDQ0.7
DPRD-PROLINEP1MCS0.7
DPRD-PROLINEA,B2AXI0.7
DPRD-PROLINEA1JY90.7
DPRD-PROLINEA2JUE0.7
DPRD-PROLINEP1MCK0.7
DPRD-PROLINEP1MCR0.7
DPRD-PROLINEA2D550.7
DPRD-PROLINEA1T8J0.7
DPRD-PROLINEA,B2EJ60.7
DPRD-PROLINEP1MCE0.7
DPRD-PROLINEP1MCI0.7
DPRD-PROLINEA,B1SNE0.7
DPRD-PROLINEA,B,C1QFI0.7
DPRD-PROLINEA,P1MCD0.7
DPRD-PROLINEA1ICL0.7
DPRD-PROLINEP1MCQ0.7
DPRD-PROLINEG,M,P,S2I5Y0.7
DPRD-PROLINEA,B,C,D3BOG0.7
DPRD-PROLINEA,L1ZEA0.7
DPRD-PROLINEA,B173D0.7
DPRD-PROLINEA,P1MCJ0.7
DPRD-PROLINEA,B,C1A7Y0.7
DPRD-PROLINEA1IC90.7
DPRD-PROLINEA,B1JY60.7
DPRD-PROLINEA209D0.7
DPRD-PROLINEA1BFW0.7
DPRD-PROLINEA,B1O6I0.7
DPRD-PROLINEA,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
DPRD-PROLINEA,B,C,D2R3C0.7
DPRD-PROLINEA,B,C,D1I3W0.7
DPRD-PROLINEA316D0.7
DPRD-PROLINEA,B,C,D1SN90.7
DPRD-PROLINEA,B,C,H,K,L2R5D0.7
DPRD-PROLINEA,B2Q330.7
DPRD-PROLINEG,M,P,S2I600.7
DPRD-PROLINEA,B1JY40.7
DPRD-PROLINEP1MCF0.7
DPRD-PROLINEA,B,C,D,E,F1UNM0.7
DPRD-PROLINEA1ICO0.7
DPRD-PROLINEA,B1XOF0.7
DPRD-PROLINEP1MCC0.7
DPRD-PROLINEA,B,C,D1SNA0.7
LALN,N-DIMETHYL-L-ALANINEA,B1R1G0.7
NCYN-METHYLCYSTEINEA,C,E,G2ADW0.73
NCYN-METHYLCYSTEINEA1VS20.73
NCYN-METHYLCYSTEINEA1PFE0.73
NCYN-METHYLCYSTEINEA,B2DA80.73
NCYN-METHYLCYSTEINEC,D193D0.73
NCYN-METHYLCYSTEINEA1XVN0.73
NCYN-METHYLCYSTEINEA,B185D0.73
NCYN-METHYLCYSTEINEA1XVK0.73
NCYN-METHYLCYSTEINEA,C1XVR0.73
MSA(2-S-METHYL) SARCOSINEC1CWK0.72
MSA(2-S-METHYL) SARCOSINEC1CWJ0.72
N2CN,S-DIMETHYLCYSTEINEA1XVK0.71
N2CN,S-DIMETHYLCYSTEINEA,C1XVR0.71
N2CN,S-DIMETHYLCYSTEINEA,B3GO30.71
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
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.72
OGAN-OXALYOLGLYCINEA2RDS0.72
OGAN-OXALYOLGLYCINEA1H2M0.72
OGAN-OXALYOLGLYCINEA2QRL0.72
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.72
OGAN-OXALYOLGLYCINEA2RDR0.72
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.72
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.72
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.72
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.72
OGAN-OXALYOLGLYCINEA1H2K0.72
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.72
OGAN-OXALYOLGLYCINEA,B2OQ70.72
NTANITRILOTRIACETIC ACIDA1GVC0.73
NTANITRILOTRIACETIC ACIDA1NFT0.73
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.72
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.72