MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02243324

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
FIC	5-fluoroindole-2-carboxylic acid	A,B	3DWS	0.78
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.74
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	B,C,D,F,G,H, J,K,L,N,O,P	2GC4	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,B,H,L,M	2J55	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2Q7Q	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,G	1JMZ	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	B,C,E,G,I	2H47	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1MG2	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	B,D,F,H,J,L, N,P	2GC7	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2OJY	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2IUP	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2AGX	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,D,H	2HJ4	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2HKR	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2AGZ	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	B,C,E,F	2H3X	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,B,D,H	2IUQ	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,G	1JMX	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,D,H	2HJB	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,C,H,L	2MTA	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,D,H	2OIZ	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,B,L,M	3C75	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2AH0	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,B,C	1JJU	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	A,B,L,M	1MDA	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2HKM	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2AGY	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	L,M	2BBK	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	L	2MAD	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2AGL	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	B,C,E	2IAA	0.71
TRQ	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO- 1H-INDOL-3-YL)-PROPIONIC ACID	D,H	2AH1	0.71
MBV	MESOBILIVERDIN IV ALPHA	A	1HE3	0.71
PYC	PYRROLE-2-CARBOXYLATE	A	1W62	0.73
PYC	PYRROLE-2-CARBOXYLATE	A,B	1L9D	0.73
PYC	PYRROLE-2-CARBOXYLATE	A,B	2CWH	0.73
PYC	PYRROLE-2-CARBOXYLATE	A,B	1W61	0.73
PYC	PYRROLE-2-CARBOXYLATE	A,B	1ELI	0.73
CLI	3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID	A,F	1LEV	0.73
4P5	4H-furo[3,2-b]pyrrole-5-carboxylic acid	A,B,C,D	3CUK	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PC2	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B,C,D	1ARZ	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PE7	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PES	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1C3V	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1P9L	0.71
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	C	2JQ7	0.71
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	B	1OLN	0.71
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	A	1E9W	0.71
CBB	1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER	B	1LPK	0.72
LBV		A	2O9B	0.7
LBV		A,B	2OOL	0.7
LBV		A	2O9C	0.7
BLA	BILIVERDINE IX ALPHA	A	1HE2	0.71
BLA	BILIVERDINE IX ALPHA	A	1ZTU	0.71
BLA	BILIVERDINE IX ALPHA	A	2D1E	0.71
BLA	BILIVERDINE IX ALPHA	A,B	2C7J	0.71
BLA	BILIVERDINE IX ALPHA	A,B,K,L	1EYX	0.71
BLA	BILIVERDINE IX ALPHA	A	1BVC	0.71
BLA	BILIVERDINE IX ALPHA	A,B	1KTP	0.71
BLA	BILIVERDINE IX ALPHA	A,B	2C7K	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUL	0.71
BLA	BILIVERDINE IX ALPHA	A	1S8C	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H	3C2W	0.71
BLA	BILIVERDINE IX ALPHA	A,B	2C7L	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D	2VGR	0.71
BLA	BILIVERDINE IX ALPHA	A	1J2C	0.71
BLA	BILIVERDINE IX ALPHA	A,B	3BRP	0.71
BLA	BILIVERDINE IX ALPHA	A	1BVD	0.71
BLA	BILIVERDINE IX ALPHA	A,B,K,L,M,N	1F99	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUM	0.71
BLA	BILIVERDINE IX ALPHA	A,B	2VUE	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, H,I,J,K,L,M	1B33	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUN	0.71
BLA	BILIVERDINE IX ALPHA	A,B,C,D	2VCK	0.71
DPY		A,B	1JES	0.72
QND	QUINALDIC ACID	A,B	1IDA	0.7
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	D,H	2I0T	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	A,B,C,D,K,L, M,N	2J57	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	D,H	2OK4	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	D,H	2IUR	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	D,H	2AGW	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	A,B,H,L,M	2J56	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	D,H	2IUV	0.71
TQQ	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID	D,H	2OK6	0.71