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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01724983

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CPV5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOPROPYL-HEXANOIC ACID
I1IVQ0.7
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2COJ1
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B,C2EJ31
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2A1H1
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2COI1
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.81
CHGCYCLOHEXYL-GLYCINEH,I4THN0.81
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.81
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.81
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.73
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.73
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
CHFCYCLOHEXYLFLUOROSTATONEE1EPR0.77
CHFCYCLOHEXYLFLUOROSTATONEA,B1OD10.77
CHFCYCLOHEXYLFLUOROSTATONEA,I2JXR0.77
CHFCYCLOHEXYLFLUOROSTATONEA,B2VS20.77
CHFCYCLOHEXYLFLUOROSTATONEI1EPO0.77
CHFCYCLOHEXYLFLUOROSTATONEA,B2JJJ0.77
CHFCYCLOHEXYLFLUOROSTATONEA,B2JJI0.77
NLH(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acidA,B,I3DCR0.71
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
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.71
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.71
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.71
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.82
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.82
CFS4-AMINO-5-CYCLOHEXYL-2,2-DIFLUORO-
3-HYDROXY-PENTANOIC ACID
A1FQ80.74
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.84
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A,B1CEB0.83
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A1B2I0.83
ZAL3-cyclohexyl-D-alanineI1HBT0.82
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.73
STASTATINEE1EPP0.7
STASTATINEI1XN30.7
STASTATINEA,B,I,J2FIV0.7
STASTATINEA,B,C,D1QS80.7
STASTATINEA,B2RMP0.7
STASTATINEE,I1APU0.7
STASTATINEA,I1GVU0.7
STASTATINEI3ER50.7
STASTATINEI2ER90.7
STASTATINEE,I4ER20.7
STASTATINEA,C,I,J,K2B7F0.7
STASTATINEA,B,C5HVP0.7
STASTATINEA,I1GVV0.7
STASTATINEA,I1WKR0.7
STASTATINEI5APR0.7
STASTATINEI1PSO0.7
STASTATINEI6APR0.7
STASTATINEA1FQ50.7
STASTATINEA,I3FNT0.7
STASTATINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.7
STASTATINEA,B,C,D,I,J1LYB0.7
STASTATINEB1FIV0.7
STASTATINEI4APR0.7
NLK(2R,5S)-5-amino-2-butyl-4-oxononanoic acidA,B,I3DCK0.71
PB13-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACIDA,B1PV80.75
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.79
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.79
DOA12-AMINO-DODECANOIC ACIDA2DCX0.79
DOA12-AMINO-DODECANOIC ACIDB1EOL0.79
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.72
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1E800.78
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1EED0.78
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I2ER00.78