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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03098757

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
U51(6E)-7-{6-[(1E)-OCT-1-ENYL]-2,3-
DIAZABICYCLO[2.2.1]HEPT-2-EN-5-
YL}HEPT-6-ENOIC ACID
A,B3B990.71
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.73
TBM4-METHYL-4-[(E)-2-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWM0.73
TBM4-METHYL-4-[(E)-2-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWJ0.73
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B1MIK0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CSA0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWL0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CYA0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,D1MF80.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1BCK0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,D,E,F,H1M630.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWC0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWI0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C,D1QNH0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H2RMC0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
T,U,V2POY0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CYN0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C,D2OJU0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H,J,L,
N,P,R,T
2RMA0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CYB0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
D1QNG0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B3CYS0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWH0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,C,D,E,F,
G,H
3BO70.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1IKF0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,M,N2Z6W0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H,J,L,
N,P
1C5F0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWO0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
D,E,F1XQ70.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWA0.78
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWF0.78
2BH[(1E,5S)-5-AMINO-5-CARBOXYPENT-
1-ENYL](TRIHYDROXY)BORATE(1-)
A,B,C1T4P0.75
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A2E2T0.77
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A3CIW0.77
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2E2V0.77
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2E2U0.77
LYRN~6~-[(2Z,4E,6E,8E)-3,7-DIMETHYL-
9-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-
1-YL)NONA-2,4,6,8-TETRAENYL]LYSINE
A,B2J4Y0.76
TZATRANS-AMICLENOMYCINA,B1MLZ0.93
TYY3-(4-HYDROXY-3-IMINO-6-OXO-CYCLOHEXA-
1,4-DIENYL)-ALANINE
A,B1D6Z0.7
ZAL3-cyclohexyl-D-alanineI1HBT0.73
ACZCIS-AMICLENOMYCINA,B1MLY0.93
GBCGABACULINEA,B,C1GBN0.75
DMT3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-
6-OCTENOIC ACID
B,D,F,H,J,L,
N,P,R,T
2RMB0.74
DMT3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-
6-OCTENOIC ACID
C1CWB0.74
DPQ(S)-2-AMINO-3-(4-HYDROXY-3-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2YX90.79
2AG(2S)-2-aminopent-4-enoic acidA,C,D3COG0.7
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.74
CHGCYCLOHEXYL-GLYCINEH,I4THN0.74
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.74
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.74
2NPL-2-AMINO-6-METHYLENE-PIMELIC ACIDA,B1F060.73
TYO(4Z,6E)-2-AMINO-7-HYDROPEROXY-4-
[(E)-2-HYDROXYVINYL]HEPTA-4,6-DIENOIC ACID
A,B2HHF0.74
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1W6C0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1W6G0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D2C100.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IQX0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D1N9E0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2CWT0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IVX0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IU70.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1JRQ0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1UI80.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1QAF0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1OAC0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1DYU0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1RKY0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,D,E2PNC0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1AV40.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D,E,F2OQE0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1W7C0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CFK0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CFL0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CFW0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CG00.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D,E,F2OOV0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1KSI0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1PU40.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1WMO0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2CFD0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2CFG0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1WMN0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2W0Q0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D,E,F1A2V0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D1W2Z0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CG10.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1US10.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IVW0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1AVL0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1QAK0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1TU50.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2BT30.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1QAL0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IQY0.75
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1RJO0.75