MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02464605

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

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	1E80	0.82
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	1EED	0.82
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	2ER0	0.82
DFI	2,2-DIFLUOROSTATINE	E,I	1APW	0.71
CPV	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOPROPYL-HEXANOIC ACID	I	1IVQ	0.86
PCE	2-(3-AMINO-4-CYCLOHEXYL-2-HYDROXY- BUTYL)-PENT-4-YNOIC ACID	A	1FQ4	0.82
AHY	(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACID	A,D	2J9A	0.76
AHH	AMINO-HYDROXYHEPTANOIC ACID	A,I	3MAT	0.72
EXY	6-[(2R)-oxiran-2-yl]-L-norleucine	A,B	3DJ8	0.79
DNN	7,8-DIAMINO-NONANOIC ACID	A	1DAH	0.72
DNN	7,8-DIAMINO-NONANOIC ACID	A	1A82	0.72
NPI	2-AMINOPIMELIC ACID	A	2TDT	0.7
NPI	2-AMINOPIMELIC ACID	A	1KGQ	0.7
LPL	LEU-HYDROXYETHYLENE-LEU	B,D,F,H	1SMR	0.84
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A,B,C	3HEZ	0.72
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A,B,C,D	3C3F	0.72
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A	3HF0	0.72
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A	3C3G	0.72
ZAL	3-cyclohexyl-D-alanine	I	1HBT	0.86
HLU	BETA-HYDROXYLEUCINE	A	1ROV	0.7
CHA	1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANE	A,B	1HRN	0.7
CHA	1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANE	A	1EAG	0.7
CHA	1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANE	A,B	1BIM	0.7
CHA	1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANE	A,B	1BIL	0.7
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2COJ	0.72
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B,C	2EJ3	0.72
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2A1H	0.72
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2COI	0.72
CHF	CYCLOHEXYLFLUOROSTATONE	E	1EPR	0.74
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	1OD1	0.74
CHF	CYCLOHEXYLFLUOROSTATONE	A,I	2JXR	0.74
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	2VS2	0.74
CHF	CYCLOHEXYLFLUOROSTATONE	I	1EPO	0.74
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	2JJJ	0.74
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	2JJI	0.74
NLK	(2R,5S)-5-amino-2-butyl-4-oxononanoic acid	A,B,I	3DCK	0.78
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5Z	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	5GDS	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2A2X	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FEQ	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2ANK	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,C,D	3DPP	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1EB1	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1NZQ	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1HBT	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D6E	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B	1B3H	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FES	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	C,D,E,G,H	3DPQ	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1THS	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1QUR	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D	3DPO	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	4THN	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,D	1D5M	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1O0D	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1XRZ	0.86
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5X	0.86
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	A	1FQ7	0.85
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	I	4ER1	0.85
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	I	3ER3	0.85
ZDR	(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A,B,C,D,E,F	3EKM	0.76
ZDR	(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A	2GKJ	0.76
DHH	(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACID	A,B,C	1T5F	0.7
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.72
XAO	CYCLOHEXYLMETHYL-2,3-DIHYDROXY- 5-METHYL-HEXYLAMIDE	A	1FQ6	0.73
XAO	CYCLOHEXYLMETHYL-2,3-DIHYDROXY- 5-METHYL-HEXYLAMIDE	I,J	1PSA	0.73
XAO	CYCLOHEXYLMETHYL-2,3-DIHYDROXY- 5-METHYL-HEXYLAMIDE	E,I	1EPQ	0.73
CAV	5-AMINO-6-CYCLOHEXYL-3,4-DIHYDROXY- 2-ISOPROPYL-HEXANOIC ACID	A,B,I	1HIV	0.8
CAV	5-AMINO-6-CYCLOHEXYL-3,4-DIHYDROXY- 2-ISOPROPYL-HEXANOIC ACID	I	1IVP	0.8
ZDP	(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A,B,C,D,E,F	3EJX	0.76
ZDP	(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A	2GKE	0.76
CHG	CYCLOHEXYL-GLYCINE	2,3,4	8KME	0.85
CHG	CYCLOHEXYL-GLYCINE	H,I	4THN	0.85
CHG	CYCLOHEXYL-GLYCINE	H,I,J	7KME	0.85
CHG	CYCLOHEXYL-GLYCINE	H,I	5GDS	0.85
NLH	(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acid	A,B,I	3DCR	0.81
KAP	7-KETO-8-AMINOPELARGONIC ACID	A,B	1QJ3	0.76
KAP	7-KETO-8-AMINOPELARGONIC ACID	A,B,C,D	3FMI	0.76
KAP	7-KETO-8-AMINOPELARGONIC ACID	A,B	3DU4	0.76
AMH	TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1CEB	0.76
AMH	TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID	A	1B2I	0.76
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	A,B	1OEX	0.84
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	A,B,I	8HVP	0.84
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	A,B	1GKT	0.84
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	E,I	2ER7	0.84
KAH	5-AMINO-4-HYDROXYHEXANOIC ACID	A	1H7P	0.7
TMD	(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N- DIMETHYL-THREONINE	C	1CWK	0.79
AHP	2-AMINO-HEPTANOIC ACID	D	1J4X	0.73
LTA	4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTER	E,I	1APT	0.74
CFS	4-AMINO-5-CYCLOHEXYL-2,2-DIFLUORO- 3-HYDROXY-PENTANOIC ACID	A	1FQ8	0.78
HHK	(2S)-2,8-DIAMINOOCTANOIC ACID	A	1XY8	0.75
NOR	CYCLOHEXYL-NORSTATINE	E,I	1EPN	0.84
NOR	CYCLOHEXYL-NORSTATINE	P	1CZI	0.84
NOR	CYCLOHEXYL-NORSTATINE	A,I	1GVT	0.84
IKT	3-(1-AMINOETHYL)NONANEDIOIC ACID	A	1DAE	0.77
STA	STATINE	E	1EPP	0.77
STA	STATINE	I	1XN3	0.77
STA	STATINE	A,B,I,J	2FIV	0.77
STA	STATINE	A,B,C,D	1QS8	0.77
STA	STATINE	A,B	2RMP	0.77
STA	STATINE	E,I	1APU	0.77
STA	STATINE	A,I	1GVU	0.77
STA	STATINE	I	3ER5	0.77
STA	STATINE	I	2ER9	0.77
STA	STATINE	E,I	4ER2	0.77
STA	STATINE	A,C,I,J,K	2B7F	0.77
STA	STATINE	A,B,C	5HVP	0.77
STA	STATINE	A,I	1GVV	0.77
STA	STATINE	A,I	1WKR	0.77
STA	STATINE	I	5APR	0.77
STA	STATINE	I	1PSO	0.77
STA	STATINE	I	6APR	0.77
STA	STATINE	A	1FQ5	0.77
STA	STATINE	A,I	3FNT	0.77
STA	STATINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	3FV3	0.77
STA	STATINE	A,B,C,D,I,J	1LYB	0.77
STA	STATINE	B	1FIV	0.77
STA	STATINE	I	4APR	0.77
ILX	4,5-DIHYDROXYISOLEUCINE	A,B,C,I,J,L,M	3CQZ	0.71
ILX	4,5-DIHYDROXYISOLEUCINE	A,B,C,I,J,L,M	1K83	0.71
ILX	4,5-DIHYDROXYISOLEUCINE	A,B,C,I,J,L, M,T	2VUM	0.71