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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03688651

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.7
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.7
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.7
CPV5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOPROPYL-HEXANOIC ACID
I1IVQ0.97
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1E800.8
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1EED0.8
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I2ER00.8
NLH(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acidA,B,I3DCR0.91
KAH5-AMINO-4-HYDROXYHEXANOIC ACIDA1H7P0.81
CHFCYCLOHEXYLFLUOROSTATONEE1EPR0.7
CHFCYCLOHEXYLFLUOROSTATONEA,B1OD10.7
CHFCYCLOHEXYLFLUOROSTATONEA,I2JXR0.7
CHFCYCLOHEXYLFLUOROSTATONEA,B2VS20.7
CHFCYCLOHEXYLFLUOROSTATONEI1EPO0.7
CHFCYCLOHEXYLFLUOROSTATONEA,B2JJJ0.7
CHFCYCLOHEXYLFLUOROSTATONEA,B2JJI0.7
LPLLEU-HYDROXYETHYLENE-LEUB,D,F,H1SMR0.97
CFS4-AMINO-5-CYCLOHEXYL-2,2-DIFLUORO-
3-HYDROXY-PENTANOIC ACID
A1FQ80.76
NLK(2R,5S)-5-amino-2-butyl-4-oxononanoic acidA,B,I3DCK0.86
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.77
STASTATINEE1EPP0.79
STASTATINEI1XN30.79
STASTATINEA,B,I,J2FIV0.79
STASTATINEA,B,C,D1QS80.79
STASTATINEA,B2RMP0.79
STASTATINEE,I1APU0.79
STASTATINEA,I1GVU0.79
STASTATINEI3ER50.79
STASTATINEI2ER90.79
STASTATINEE,I4ER20.79
STASTATINEA,C,I,J,K2B7F0.79
STASTATINEA,B,C5HVP0.79
STASTATINEA,I1GVV0.79
STASTATINEA,I1WKR0.79
STASTATINEI5APR0.79
STASTATINEI1PSO0.79
STASTATINEI6APR0.79
STASTATINEA1FQ50.79
STASTATINEA,I3FNT0.79
STASTATINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.79
STASTATINEA,B,C,D,I,J1LYB0.79
STASTATINEB1FIV0.79
STASTATINEI4APR0.79
CAL5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOBUTYL-HEXANOIC ACID
A1FQ70.93
CAL5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOBUTYL-HEXANOIC ACID
I4ER10.93
CAL5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOBUTYL-HEXANOIC ACID
I3ER30.93
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EJX0.74
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKE0.74
LTA4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTERE,I1APT0.72
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EKM0.74
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKJ0.74
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.75
CHGCYCLOHEXYL-GLYCINEH,I4THN0.75
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.75
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.75
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.7
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.71
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.71
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.71
PCE2-(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-
BUTYL)-PENT-4-YNOIC ACID
A1FQ40.89
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.72
ZAL3-cyclohexyl-D-alanineI1HBT0.76
CAV5-AMINO-6-CYCLOHEXYL-3,4-DIHYDROXY-
2-ISOPROPYL-HEXANOIC ACID
A,B,I1HIV0.87
CAV5-AMINO-6-CYCLOHEXYL-3,4-DIHYDROXY-
2-ISOPROPYL-HEXANOIC ACID
I1IVP0.87
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.76
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.74
NORCYCLOHEXYL-NORSTATINEE,I1EPN0.75
NORCYCLOHEXYL-NORSTATINEP1CZI0.75
NORCYCLOHEXYL-NORSTATINEA,I1GVT0.75
PB13-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACIDA,B1PV80.75
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.77
AR9(2R,4S)-N-butyl-4-[(2S,5S,7R)-2,7-
dimethyl-3,15-dioxo-1,4-diazacyclopentadecan-
5-yl]-4-hydroxy-2-methylbutanamide
A,B,C3DV10.7
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
A,B1OEX1
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
A,B,I8HVP1
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
A,B1GKT1
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
E,I2ER71
DFI2,2-DIFLUOROSTATINEE,I1APW0.74