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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00049576

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A1P1O0.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A,B1S9T0.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A,B1MM60.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A2JBK0.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A,B,C,D,E,F2AL40.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A,B,C1MM70.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A3B6T0.8
QUS(S)-2-AMINO-3-(3,5-DIOXO-[1,2,4]OXADIAZOLIDIN-
2-YL)-PROPIONIC ACID
A2OR40.8
AYAN-ACETYLALANINEA1D0W0.74
AYAN-ACETYLALANINEA1AH40.74
AYAN-ACETYLALANINEA,B1VBP0.74
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.74
AYAN-ACETYLALANINEA,B,C,D1OUW0.74
AYAN-ACETYLALANINEA1AH30.74
AYAN-ACETYLALANINEA1EKO0.74
AYAN-ACETYLALANINEB,D,F,H2V4I0.74
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.74
AYAN-ACETYLALANINEA,B,C,D1J4U0.74
CDT4-METHYLSULFANYL-2-UREIDO-BUTYRIC ACIDA,B1UF50.73
DNP3-AMINO-ALANINEA1BEI0.76
NXAN-CARBOXYALANINEA2IUX0.72
NXAN-CARBOXYALANINEA1O8A0.72
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.85
VLL(2S)-2,3-DIAMINOBUTANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.73
DPPDIAMMINOPROPANOIC ACIDA,B1B5H0.76
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.79
HWD2-AMINO-3-(2,4-DIOXO-3,4-DIHYDRO-
2H-PYRIMIDIN-1-YL)-PROPIONIC ACID
A1MQJ0.7
CIRCITRULLINEA,B,C,D1J210.76
CIRCITRULLINEB1KOD0.76
CIRCITRULLINEA,B,C3B3I0.76
CIRCITRULLINEC3DTX0.76
CIRCITRULLINEA2C6Z0.76
CIRCITRULLINEA,C,E,F2W650.76
CIRCITRULLINEA,B2JAI0.76
CIRCITRULLINEP3FT20.76
CIRCITRULLINEA,B,C,D1J1Z0.76
CIRCITRULLINEA,B1LXY0.76
CIRCITRULLINEF,H1OL10.76
CIRCITRULLINEA1KP30.76
CIRCITRULLINEA2NZ20.76
CIRCITRULLINEA1H700.76
CIRCITRULLINEA1K970.76
CIRCITRULLINEC3B6S0.76
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.75
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B,C,D,E,F,
G,H
1T6P0.73
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B1T6J0.73
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8V0.88
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2FVM0.88
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8H0.88
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1GH00.71
MENN-METHYL ASPARAGINEA,B,C,D1XF60.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.71
MENN-METHYL ASPARAGINEA,B1I7Y0.71
MENN-METHYL ASPARAGINEA,B3BRP0.71
MENN-METHYL ASPARAGINEA,B1JBO0.71
MENN-METHYL ASPARAGINEA,B1ALL0.71
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1HA70.71
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.71
MENN-METHYL ASPARAGINEA,B1KTP0.71
MENN-METHYL ASPARAGINEA,B1PHN0.71
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.71
MENN-METHYL ASPARAGINEA,B,C,D1XG00.71
MENN-METHYL ASPARAGINEA,B2VJT0.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.71
MENN-METHYL ASPARAGINEA,B2V8A0.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.71
IWD2-AMINO-3-(5-IODO-2,4-DIOXO-3,4-
DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID
A,B1MQG0.7
IWD2-AMINO-3-(5-IODO-2,4-DIOXO-3,4-
DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID
A,B,C1MY40.7
FWD2-AMINO-3-(5-FLUORO-2,4-DIOXO-3,4-
DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID
A,B2AL50.71
FWD2-AMINO-3-(5-FLUORO-2,4-DIOXO-3,4-
DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID
A1MQI0.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.82
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.82
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.82
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.82
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.82
SYS3-[(2-amino-2-oxoethyl)selanyl]-
L-alanine
A,B,C,D3BOG0.72
DIR3-{[(E)-AMINO(HYDROXYIMINO)METHYL]AMINO}ALANINEA,B,C1T4T0.82
NC3N-[(CYCLOHEXYLAMINO)CARBONYL]GLYCINEP1ZD20.72
VDL(2R,3R)-2,3-DIAMINOBUTANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.73
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