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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03373576

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DFI2,2-DIFLUOROSTATINEE,I1APW0.71
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.86
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3HF00.75
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA,B,D,E,F3FDM0.75
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3C3H0.75
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.71
HLUBETA-HYDROXYLEUCINEA1ROV0.78
LYZ5-HYDROXYLYSINEA,B,C,D1QGW0.7
LYZ5-HYDROXYLYSINEA,B,C,D1XG00.7
LYZ5-HYDROXYLYSINEA,B,C,D1XF60.7
LYZ5-HYDROXYLYSINEA,B,C1YGV0.7
LYZ5-HYDROXYLYSINEA,B,C1Y0F0.7
DLED-LEUCINEA,B1ALZ0.73
DLED-LEUCINEA,B1BDW0.73
DLED-LEUCINEA,D1CZQ0.73
DLED-LEUCINEA1BFW0.73
DLED-LEUCINEE,F,G,H1XN20.73
DLED-LEUCINEA,B,C,D1GMK0.73
DLED-LEUCINEA,B1TKQ0.73
DLED-LEUCINEA,B,C,H,K,L2R5D0.73
DLED-LEUCINEA2NPV0.73
DLED-LEUCINEA,B,C,D2R3C0.73
DLED-LEUCINEB,D,E1AFQ0.73
DLED-LEUCINEA,B1MIC0.73
DLED-LEUCINEA,B1NRU0.73
DLED-LEUCINEA,B1JNO0.73
DLED-LEUCINEA,B1GRM0.73
DLED-LEUCINEA,B1NRM0.73
DLED-LEUCINEA,D2Q3I0.73
DLED-LEUCINEA,B1NT50.73
DLED-LEUCINEA2JUE0.73
DLED-LEUCINEA,B,C,D1AV20.73
DLED-LEUCINEA1YY20.73
DLED-LEUCINEA,B1AL40.73
DLED-LEUCINEA,B1NG80.73
DLED-LEUCINEA,B1ALX0.73
DLED-LEUCINEA,B1JO40.73
DLED-LEUCINEA,B,C,H,K,L2R5B0.73
DLED-LEUCINEA,B1MAG0.73
DLED-LEUCINEA,B1NT60.73
DLED-LEUCINEA,B2Q330.73
DLED-LEUCINEA,B1JO30.73
DLED-LEUCINEE,I1BLL0.73
DLED-LEUCINEA,B1KQE0.73
DLED-LEUCINEA,B,C,D1W5U0.73
DLED-LEUCINEA,B,C,D2IZQ0.73
DLED-LEUCINEA1C4B0.73
DLED-LEUCINEA,B,C,D1C4D0.73
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.82
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.83
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.83
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.83
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.83
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.83
NORCYCLOHEXYL-NORSTATINEE,I1EPN0.82
NORCYCLOHEXYL-NORSTATINEP1CZI0.82
NORCYCLOHEXYL-NORSTATINEA,I1GVT0.82
LPLLEU-HYDROXYETHYLENE-LEUB,D,F,H1SMR0.72
42B4-AMINO-2-HYDROXYBUTANOIC ACIDB1O9M0.7
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.71
LED(4R)-5-OXO-L-LEUCINEA2IUW0.71
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.71
DNED-NORLEUCINEA1R9V0.7
DNED-NORLEUCINEA,B1S4A0.7
DNED-NORLEUCINEA,B1S1O0.7
DILD-ISOLEUCINEA,B2Q330.7
DILD-ISOLEUCINEA1CWZ0.7
DILD-ISOLEUCINEA1CVQ0.7
DILD-ISOLEUCINEA1C4B0.7
DILD-ISOLEUCINEA1CW80.7
DILD-ISOLEUCINEA2AP80.7
IILISO-ISOLEUCINEA,B,C,D1Q4V0.7
IILISO-ISOLEUCINEA1KMF0.7
IILISO-ISOLEUCINEA,B,C1TGG0.7
IILISO-ISOLEUCINEA1RH40.7
STASTATINEE1EPP0.74
STASTATINEI1XN30.74
STASTATINEA,B,I,J2FIV0.74
STASTATINEA,B,C,D1QS80.74
STASTATINEA,B2RMP0.74
STASTATINEE,I1APU0.74
STASTATINEA,I1GVU0.74
STASTATINEI3ER50.74
STASTATINEI2ER90.74
STASTATINEE,I4ER20.74
STASTATINEA,C,I,J,K2B7F0.74
STASTATINEA,B,C5HVP0.74
STASTATINEA,I1GVV0.74
STASTATINEA,I1WKR0.74
STASTATINEI5APR0.74
STASTATINEI1PSO0.74
STASTATINEI6APR0.74
STASTATINEA1FQ50.74
STASTATINEA,I3FNT0.74
STASTATINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.74
STASTATINEA,B,C,D,I,J1LYB0.74
STASTATINEB1FIV0.74
STASTATINEI4APR0.74
EKE(4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACIDA,I2HAL0.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.8
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.8
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.8
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.8
NLENORLEUCINEA1MMT0.7
NLENORLEUCINEA,B1JB60.7
NLENORLEUCINEC1K2B0.7
NLENORLEUCINEA,B,C2AVQ0.7
NLENORLEUCINEC,D,I,L1R1L0.7
NLENORLEUCINEE,S2RLN0.7
NLENORLEUCINEE,S1Z3L0.7
NLENORLEUCINEA,B,C2AOD0.7
NLENORLEUCINEA,B,C2J9J0.7
NLENORLEUCINEA,B,I4HVP0.7
NLENORLEUCINEA,B,C2AVM0.7
NLENORLEUCINEB,C1K1T0.7
NLENORLEUCINEA,B,C2AOC0.7
NLENORLEUCINEA,B,C2JE40.7
NLENORLEUCINEA,B,I3DCK0.7
NLENORLEUCINEB1EOL0.7
NLENORLEUCINEA1FF00.7
NLENORLEUCINEA1FG60.7
NLENORLEUCINEA1FGC0.7
NLENORLEUCINEE,S1Z3M0.7
NLENORLEUCINEA2RME0.7
NLENORLEUCINEB1FGL0.7
NLENORLEUCINEC1K1U0.7
NLENORLEUCINEA,B1B7H0.7
NLENORLEUCINEA1HTH0.7
NLENORLEUCINEA,B,D2J9K0.7
NLENORLEUCINEA2RMD0.7
NLENORLEUCINEA,B,C2AOG0.7
NLENORLEUCINEA2RMI0.7
NLENORLEUCINEI1EPO0.7
NLENORLEUCINEA1FFI0.7
NLENORLEUCINEA1HD90.7
NLENORLEUCINEA1FFF0.7
NLENORLEUCINEB2JND0.7
NLENORLEUCINEA1FEJ0.7
NLENORLEUCINEA2K9E0.7
NLENORLEUCINEC1CFN0.7
NLENORLEUCINEC1K2C0.7
NLENORLEUCINEA1WY40.7
NLENORLEUCINEA1FQ80.7
NLENORLEUCINEA,B1S1O0.7
NLENORLEUCINEA2F4K0.7
NLENORLEUCINEA,B1D5E0.7
NLENORLEUCINEA2JX40.7
NLENORLEUCINEA1FG80.7
NLENORLEUCINEA1WY30.7
NLENORLEUCINEI1YTJ0.7
NLENORLEUCINEA,B,I3DCR0.7
NLENORLEUCINEA,I2O400.7
NLENORLEUCINEA,B2GYP0.7
NLENORLEUCINEC,F1A8K0.7
NLENORLEUCINEC1BAI0.7
NLENORLEUCINEA,B2JT90.7
NLENORLEUCINEA2RM90.7
NLENORLEUCINEA,B1DAZ0.7
NLENORLEUCINEA1F3R0.7
NLENORLEUCINEA,I2JXR0.7
NLENORLEUCINEC,F1A940.7
NLENORLEUCINEA,B1S4A0.7
NLENORLEUCINEA1R9V0.7
NLENORLEUCINEA,B,C,D,E,F2Z2T0.7
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M3CQZ0.76
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M1K830.76
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,
M,T
2VUM0.76
KAH5-AMINO-4-HYDROXYHEXANOIC ACIDA1H7P0.73