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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02311694

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DLED-LEUCINEA,B1ALZ0.78
DLED-LEUCINEA,B1BDW0.78
DLED-LEUCINEA,D1CZQ0.78
DLED-LEUCINEA1BFW0.78
DLED-LEUCINEE,F,G,H1XN20.78
DLED-LEUCINEA,B,C,D1GMK0.78
DLED-LEUCINEA,B1TKQ0.78
DLED-LEUCINEA,B,C,H,K,L2R5D0.78
DLED-LEUCINEA2NPV0.78
DLED-LEUCINEA,B,C,D2R3C0.78
DLED-LEUCINEB,D,E1AFQ0.78
DLED-LEUCINEA,B1MIC0.78
DLED-LEUCINEA,B1NRU0.78
DLED-LEUCINEA,B1JNO0.78
DLED-LEUCINEA,B1GRM0.78
DLED-LEUCINEA,B1NRM0.78
DLED-LEUCINEA,D2Q3I0.78
DLED-LEUCINEA,B1NT50.78
DLED-LEUCINEA2JUE0.78
DLED-LEUCINEA,B,C,D1AV20.78
DLED-LEUCINEA1YY20.78
DLED-LEUCINEA,B1AL40.78
DLED-LEUCINEA,B1NG80.78
DLED-LEUCINEA,B1ALX0.78
DLED-LEUCINEA,B1JO40.78
DLED-LEUCINEA,B,C,H,K,L2R5B0.78
DLED-LEUCINEA,B1MAG0.78
DLED-LEUCINEA,B1NT60.78
DLED-LEUCINEA,B2Q330.78
DLED-LEUCINEA,B1JO30.78
DLED-LEUCINEE,I1BLL0.78
DLED-LEUCINEA,B1KQE0.78
DLED-LEUCINEA,B,C,D1W5U0.78
DLED-LEUCINEA,B,C,D2IZQ0.78
DLED-LEUCINEA1C4B0.78
DLED-LEUCINEA,B,C,D1C4D0.78
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.7
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EJX0.78
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKE0.78
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.71
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.75
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.73
BIU5-bromo-L-isoleucineA3EDS0.71
GAMALPHA-METHYL-L-GLUTAMIC ACIDA,B1BJO0.79
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.7
1921-AMINOCYCLOBUTANECARBOXLIC ACIDA1Y1Z0.81
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.73
AIBALPHA-AMINOISOBUTYRIC ACIDA,B1OB60.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1FVN0.72
AIBALPHA-AMINOISOBUTYRIC ACIDH,I4THN0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA3CMH0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA6CMH0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,B,C1AMT0.72
AIBALPHA-AMINOISOBUTYRIC ACIDP1F580.72
AIBALPHA-AMINOISOBUTYRIC ACIDP,Q,R,S2FX80.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1GQ00.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1R9U0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1OB70.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,B1FEV0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1DLZ0.72
AIBALPHA-AMINOISOBUTYRIC ACIDB2GV20.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1IH90.72
AIBALPHA-AMINOISOBUTYRIC ACIDL3FE70.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1GO90.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1GOE0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,L,M3FEA0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1OB40.72
AIBALPHA-AMINOISOBUTYRIC ACIDH,I5GDS0.72
AIBALPHA-AMINOISOBUTYRIC ACIDE,I1QR30.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,B1JOH0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,B1M240.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,B1V6D0.72
AIBALPHA-AMINOISOBUTYRIC ACIDA,B,C,D,F,Q1EFR0.72
AIBALPHA-AMINOISOBUTYRIC ACIDP1AI10.72
AIBALPHA-AMINOISOBUTYRIC ACIDA1EE70.72
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.75
MLEN-METHYLLEUCINEA,D2J9A0.7
MLEN-METHYLLEUCINEC1IKF0.7
MLEN-METHYLLEUCINEA,M,N2Z6W0.7
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.7
MLEN-METHYLLEUCINED,E,F1XQ70.7
MLEN-METHYLLEUCINEC1CWA0.7
MLEN-METHYLLEUCINEC1CWF0.7
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.7
MLEN-METHYLLEUCINEB3CYS0.7
MLEN-METHYLLEUCINEC1CWH0.7
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.7
MLEN-METHYLLEUCINEC1CYN0.7
MLEN-METHYLLEUCINEA1LV90.7
MLEN-METHYLLEUCINEC,D2OJU0.7
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.7
MLEN-METHYLLEUCINEA1IKM0.7
MLEN-METHYLLEUCINEC1CWK0.7
MLEN-METHYLLEUCINEA,B2HG80.7
MLEN-METHYLLEUCINEC1CWB0.7
MLEN-METHYLLEUCINEC1CWJ0.7
MLEN-METHYLLEUCINEA1CYB0.7
MLEN-METHYLLEUCINED1QNG0.7
MLEN-METHYLLEUCINEB1MIK0.7
MLEN-METHYLLEUCINEA1CSA0.7
MLEN-METHYLLEUCINEC1CWL0.7
MLEN-METHYLLEUCINEA1CYA0.7
MLEN-METHYLLEUCINEA,B,D1MF80.7
MLEN-METHYLLEUCINEC1BCK0.7
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.7
MLEN-METHYLLEUCINEC1CWC0.7
MLEN-METHYLLEUCINEC1CWI0.7
MLEN-METHYLLEUCINEC,D1QNH0.7
MLEN-METHYLLEUCINEB,D,F,H2RMC0.7
MLEN-METHYLLEUCINEC1CWM0.7
MLEN-METHYLLEUCINET,U,V2POY0.7
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.7
MLEN-METHYLLEUCINEC1CWO0.7
MLEN-METHYLLEUCINEA1IKL0.7
ZAL3-cyclohexyl-D-alanineI1HBT0.75
DMOALPHA-DIFLUOROMETHYLORNITHINEA,B,C,D2TOD0.7
CPC2-METHYL-1-METHYLAMINO-CYCLOPROPANE CARBOXYLIC ACIDC,D193D0.7
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.73
CHGCYCLOHEXYL-GLYCINEH,I4THN0.73
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.73
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.73
AC51-AMINOCYCLOPENTANECARBOXYLIC ACIDA,B1Y1M0.82
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.74
NVANORVALINEB,C1CA80.74
NVANORVALINEB,C,D1BA80.74
NVANORVALINEA1C9Y0.74
NVANORVALINEA,D2BTE0.74
NVANORVALINEA1OBH0.74
NVANORVALINEE,S1Z3P0.74
NVANORVALINEA1ZNM0.74
NVANORVALINEA1JDX0.74
NVANORVALINEA1FB50.74
NVANORVALINEA1OBC0.74
NVANORVALINE11YYY0.74
NVANORVALINEA,B1B6H0.74
NVANORVALINEA,B1ZZZ0.74
NVANORVALINEA,B,C2I6U0.74
NVANORVALINEB,C1BB00.74
NVANORVALINEE,S1Z3M0.74
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.7
DILD-ISOLEUCINEA,B2Q330.78
DILD-ISOLEUCINEA1CWZ0.78
DILD-ISOLEUCINEA1CVQ0.78
DILD-ISOLEUCINEA1C4B0.78
DILD-ISOLEUCINEA1CW80.78
DILD-ISOLEUCINEA2AP80.78
IILISO-ISOLEUCINEA,B,C,D1Q4V0.78
IILISO-ISOLEUCINEA1KMF0.78
IILISO-ISOLEUCINEA,B,C1TGG0.78
IILISO-ISOLEUCINEA1RH40.78
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBM0.75
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBN0.75
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBU0.75
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBO0.75
MGN2-METHYL-GLUTAMINEA,C,D,F1MRO0.75
DNED-NORLEUCINEA1R9V0.72
DNED-NORLEUCINEA,B1S4A0.72
DNED-NORLEUCINEA,B1S1O0.72
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.7
A332-(carboxymethyl)-D-aspartic acidA,B3B3X0.71
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.7
NLENORLEUCINEA1MMT0.72
NLENORLEUCINEA,B1JB60.72
NLENORLEUCINEC1K2B0.72
NLENORLEUCINEA,B,C2AVQ0.72
NLENORLEUCINEC,D,I,L1R1L0.72
NLENORLEUCINEE,S2RLN0.72
NLENORLEUCINEE,S1Z3L0.72
NLENORLEUCINEA,B,C2AOD0.72
NLENORLEUCINEA,B,C2J9J0.72
NLENORLEUCINEA,B,I4HVP0.72
NLENORLEUCINEA,B,C2AVM0.72
NLENORLEUCINEB,C1K1T0.72
NLENORLEUCINEA,B,C2AOC0.72
NLENORLEUCINEA,B,C2JE40.72
NLENORLEUCINEA,B,I3DCK0.72
NLENORLEUCINEB1EOL0.72
NLENORLEUCINEA1FF00.72
NLENORLEUCINEA1FG60.72
NLENORLEUCINEA1FGC0.72
NLENORLEUCINEE,S1Z3M0.72
NLENORLEUCINEA2RME0.72
NLENORLEUCINEB1FGL0.72
NLENORLEUCINEC1K1U0.72
NLENORLEUCINEA,B1B7H0.72
NLENORLEUCINEA1HTH0.72
NLENORLEUCINEA,B,D2J9K0.72
NLENORLEUCINEA2RMD0.72
NLENORLEUCINEA,B,C2AOG0.72
NLENORLEUCINEA2RMI0.72
NLENORLEUCINEI1EPO0.72
NLENORLEUCINEA1FFI0.72
NLENORLEUCINEA1HD90.72
NLENORLEUCINEA1FFF0.72
NLENORLEUCINEB2JND0.72
NLENORLEUCINEA1FEJ0.72
NLENORLEUCINEA2K9E0.72
NLENORLEUCINEC1CFN0.72
NLENORLEUCINEC1K2C0.72
NLENORLEUCINEA1WY40.72
NLENORLEUCINEA1FQ80.72
NLENORLEUCINEA,B1S1O0.72
NLENORLEUCINEA2F4K0.72
NLENORLEUCINEA,B1D5E0.72
NLENORLEUCINEA2JX40.72
NLENORLEUCINEA1FG80.72
NLENORLEUCINEA1WY30.72
NLENORLEUCINEI1YTJ0.72
NLENORLEUCINEA,B,I3DCR0.72
NLENORLEUCINEA,I2O400.72
NLENORLEUCINEA,B2GYP0.72
NLENORLEUCINEC,F1A8K0.72
NLENORLEUCINEC1BAI0.72
NLENORLEUCINEA,B2JT90.72
NLENORLEUCINEA2RM90.72
NLENORLEUCINEA,B1DAZ0.72
NLENORLEUCINEA1F3R0.72
NLENORLEUCINEA,I2JXR0.72
NLENORLEUCINEC,F1A940.72
NLENORLEUCINEA,B1S4A0.72
NLENORLEUCINEA1R9V0.72
NLENORLEUCINEA,B,C,D,E,F2Z2T0.72
IMLN-METHYL-ISOLEUCINEC1CWM0.7
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EKM0.78
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKJ0.78
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.7
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.7
2ML2-METHYLLEUCINEA,B,C1I1L0.87
2ML2-METHYLLEUCINEA2RM90.87
2ML2-METHYLLEUCINEA2RMD0.87
DIVD-ISOVALINEA1IH90.78
DIVD-ISOVALINEA1DLZ0.78
DIVD-ISOVALINEA1OB40.78
DIVD-ISOVALINEA,B1JOH0.78
DIVD-ISOVALINEA1EE70.78
DIVD-ISOVALINEA,B1OB60.78
DIVD-ISOVALINEA1GQ00.78
DIVD-ISOVALINEA1OB70.78
DIVD-ISOVALINEA1R9U0.78