MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02220869

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
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2COJ	0.7
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B,C	2EJ3	0.7
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2A1H	0.7
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2COI	0.7
CHG	CYCLOHEXYL-GLYCINE	2,3,4	8KME	0.8
CHG	CYCLOHEXYL-GLYCINE	H,I	4THN	0.8
CHG	CYCLOHEXYL-GLYCINE	H,I,J	7KME	0.8
CHG	CYCLOHEXYL-GLYCINE	H,I	5GDS	0.8
AHP	2-AMINO-HEPTANOIC ACID	D	1J4X	0.71
DNN	7,8-DIAMINO-NONANOIC ACID	A	1DAH	0.7
DNN	7,8-DIAMINO-NONANOIC ACID	A	1A82	0.7
LPL	LEU-HYDROXYETHYLENE-LEU	B,D,F,H	1SMR	0.75
CPV	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOPROPYL-HEXANOIC ACID	I	1IVQ	0.77
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
TMD	(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N- DIMETHYL-THREONINE	C	1CWK	0.73
DNM	N-METHYL-D-NORLEUCINE	A,B	1S1O	0.7
DNM	N-METHYL-D-NORLEUCINE	A,B	1S4A	0.7
DNM	N-METHYL-D-NORLEUCINE	A	1R9V	0.7
3GA	3-PIPERIDYL-N-GUANIDINO-L-ALANINE	B,C	1BB0	0.73
3GA	3-PIPERIDYL-N-GUANIDINO-L-ALANINE	1	1YYY	0.73
3GA	3-PIPERIDYL-N-GUANIDINO-L-ALANINE	B,C	1CA8	0.73
1PI	3-(1-CARBAMIMIDOYL-PIPERIDIN-3- YL)-L-ALANINE	A,B	1ZZZ	0.73
CYJ	(Z)-N~6~-[(4R,5S)-5-(2-CARBOXYETHYL)- 4-(CARBOXYMETHYL)PIPERIDIN-3-YLIDENE]- L-LYSINE	A,B	2C14	0.74
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.78
XCP	(1S,2S)-2-aminocyclopentanecarboxylic acid	A	3HF0	0.7
XCP	(1S,2S)-2-aminocyclopentanecarboxylic acid	A,B,D,E,F	3FDM	0.7
XCP	(1S,2S)-2-aminocyclopentanecarboxylic acid	A	3C3H	0.7
ZDR	(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A,B,C,D,E,F	3EKM	0.71
ZDR	(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A	2GKJ	0.71
MLE	N-METHYLLEUCINE	A,D	2J9A	0.7
MLE	N-METHYLLEUCINE	C	1IKF	0.7
MLE	N-METHYLLEUCINE	A,M,N	2Z6W	0.7
MLE	N-METHYLLEUCINE	B,D,F,H,J,L, N,P	1C5F	0.7
MLE	N-METHYLLEUCINE	D,E,F	1XQ7	0.7
MLE	N-METHYLLEUCINE	C	1CWA	0.7
MLE	N-METHYLLEUCINE	C	1CWF	0.7
MLE	N-METHYLLEUCINE	B,D,F,H,J,L, N,P,R,T	2RMB	0.7
MLE	N-METHYLLEUCINE	B	3CYS	0.7
MLE	N-METHYLLEUCINE	C	1CWH	0.7
MLE	N-METHYLLEUCINE	A,B,C,D,E,F, G,H	3BO7	0.7
MLE	N-METHYLLEUCINE	C	1CYN	0.7
MLE	N-METHYLLEUCINE	A	1LV9	0.7
MLE	N-METHYLLEUCINE	C,D	2OJU	0.7
MLE	N-METHYLLEUCINE	B,D,F,H,J,L, N,P,R,T	2RMA	0.7
MLE	N-METHYLLEUCINE	A	1IKM	0.7
MLE	N-METHYLLEUCINE	C	1CWK	0.7
MLE	N-METHYLLEUCINE	A,B	2HG8	0.7
MLE	N-METHYLLEUCINE	C	1CWB	0.7
MLE	N-METHYLLEUCINE	C	1CWJ	0.7
MLE	N-METHYLLEUCINE	A	1CYB	0.7
MLE	N-METHYLLEUCINE	D	1QNG	0.7
MLE	N-METHYLLEUCINE	B	1MIK	0.7
MLE	N-METHYLLEUCINE	A	1CSA	0.7
MLE	N-METHYLLEUCINE	C	1CWL	0.7
MLE	N-METHYLLEUCINE	A	1CYA	0.7
MLE	N-METHYLLEUCINE	A,B,D	1MF8	0.7
MLE	N-METHYLLEUCINE	C	1BCK	0.7
MLE	N-METHYLLEUCINE	A,B,D,E,F,H	1M63	0.7
MLE	N-METHYLLEUCINE	C	1CWC	0.7
MLE	N-METHYLLEUCINE	C	1CWI	0.7
MLE	N-METHYLLEUCINE	C,D	1QNH	0.7
MLE	N-METHYLLEUCINE	B,D,F,H	2RMC	0.7
MLE	N-METHYLLEUCINE	C	1CWM	0.7
MLE	N-METHYLLEUCINE	T,U,V	2POY	0.7
MLE	N-METHYLLEUCINE	A,B,C,D,E,F, I,J,K,L,M,N	2ESL	0.7
MLE	N-METHYLLEUCINE	C	1CWO	0.7
MLE	N-METHYLLEUCINE	A	1IKL	0.7
IKT	3-(1-AMINOETHYL)NONANEDIOIC ACID	A	1DAE	0.75
RPH	6-HYDROXO-OCTAHYDRO-INDOLE-2-CARBALDEHYDE	H,I	1A2C	0.73
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	A	1FQ7	0.76
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	I	4ER1	0.76
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	I	3ER3	0.76
ZDP	(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A,B,C,D,E,F	3EJX	0.71
ZDP	(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A	2GKE	0.71
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	A,B	1OEX	0.75
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	A,B,I	8HVP	0.75
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	A,B	1GKT	0.75
LOV	5-AMINO-4-HYDROXY-2-ISOPROPYL-7- METHYL-OCTANOIC ACID	E,I	2ER7	0.75
NC7	7-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}HEPTANOIC ACID	A	1ZD5	0.72
MLZ	N-METHYL-LYSINE	A,B,I,J	2PXJ	0.7
MLZ	N-METHYL-LYSINE	A,B,E,F	1XQH	0.7
MLZ	N-METHYL-LYSINE	A,B,C,D	2G46	0.7
MLZ	N-METHYL-LYSINE	D	2B2V	0.7
MLZ	N-METHYL-LYSINE	A,B	3CBM	0.7
MLZ	N-METHYL-LYSINE	A,B,C,D	2OT7	0.7
MLZ	N-METHYL-LYSINE	A,B,E,F	3F9Y	0.7
MLZ	N-METHYL-LYSINE	P	1Q3L	0.7
MLZ	N-METHYL-LYSINE	A,B,E,F	2BQZ	0.7
MLZ	N-METHYL-LYSINE	A	2RHY	0.7
MLZ	N-METHYL-LYSINE	A,B	2F69	0.7
MLZ	N-METHYL-LYSINE	A	2R5A	0.7
MLZ	N-METHYL-LYSINE	A,B	3F70	0.7
MLZ	N-METHYL-LYSINE	A,B,C	2H2J	0.7
MLZ	N-METHYL-LYSINE	C,D	2H6K	0.7
MLZ	N-METHYL-LYSINE	A	3EPQ	0.7
MLZ	N-METHYL-LYSINE	A,B	2QNU	0.7
MLZ	N-METHYL-LYSINE	A,B,C,D	3HHL	0.7
MLZ	N-METHYL-LYSINE	A	1IV8	0.7
MLZ	N-METHYL-LYSINE	A	1XER	0.7
MLZ	N-METHYL-LYSINE	B,D	2H9N	0.7
MLZ	N-METHYL-LYSINE	L	2R5M	0.7
MLZ	N-METHYL-LYSINE	A	3E3X	0.7
MLZ	N-METHYL-LYSINE	A,B	2VYT	0.7
MLZ	N-METHYL-LYSINE	A,B,K,L	1O9S	0.7
MLZ	N-METHYL-LYSINE	A,B,C	1P0Y	0.7
MLZ	N-METHYL-LYSINE	A,B	3CBO	0.7
ZAL	3-cyclohexyl-D-alanine	I	1HBT	0.79
MCP	2-CARBOXY-4-METHYLPIPERIDINE	H	1ETR	0.76
NLH	(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acid	A,B,I	3DCR	0.79
PCE	2-(3-AMINO-4-CYCLOHEXYL-2-HYDROXY- BUTYL)-PENT-4-YNOIC ACID	A	1FQ4	0.73
OIC	OCTAHYDROINDOLE-2-CARBOXYLIC ACID	B,C	3BV9	0.81
OIC	OCTAHYDROINDOLE-2-CARBOXYLIC ACID	A	1BDK	0.81
IML	N-METHYL-ISOLEUCINE	C	1CWM	0.7
SSC	(2S,5S)-5-CARBOXYMETHYLPROLINE	A,B,C,D	1Q19	0.72
PB1	3-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACID	A,B	1PV8	0.75
LDH	N~6~-ETHYL-L-LYSINE	A,K	2IOF	0.71
AMH	TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1CEB	0.8
AMH	TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID	A	1B2I	0.8
NLK	(2R,5S)-5-amino-2-butyl-4-oxononanoic acid	A,B,I	3DCK	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5Z	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	5GDS	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2A2X	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FEQ	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2ANK	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,C,D	3DPP	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1EB1	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1NZQ	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1HBT	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D6E	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B	1B3H	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FES	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	C,D,E,G,H	3DPQ	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1THS	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1QUR	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D	3DPO	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	4THN	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,D	1D5M	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1O0D	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1XRZ	0.79
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5X	0.79