MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02181531

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
NGV	METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11- TRIOXO-3,4,6,11-TETRAHYDROTETRACENE- 1-CARBOXYLATE	A,B,C,D	2F98	0.72
NGV	METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11- TRIOXO-3,4,6,11-TETRAHYDROTETRACENE- 1-CARBOXYLATE	A	1SJW	0.72
BEZ	BENZOIC ACID	A,B	2F8D	0.75
BEZ	BENZOIC ACID	A,B	1A8U	0.75
BEZ	BENZOIC ACID	A,B	1REE	0.75
BEZ	BENZOIC ACID	A	1L7Q	0.75
BEZ	BENZOIC ACID	A	1I69	0.75
BEZ	BENZOIC ACID	H,L	1RUL	0.75
BEZ	BENZOIC ACID	A,B	3CCF	0.75
BEZ	BENZOIC ACID	A	1W9Q	0.75
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.75
BEZ	BENZOIC ACID	H,L	1RUA	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1H4O	0.75
BEZ	BENZOIC ACID	H,L	1RU9	0.75
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.75
BEZ	BENZOIC ACID	A	2QMQ	0.75
BEZ	BENZOIC ACID	A	1UKB	0.75
BEZ	BENZOIC ACID	A,B	1RED	0.75
BEZ	BENZOIC ACID	A,B	1OC3	0.75
BEZ	BENZOIC ACID	A,B	1REF	0.75
BEZ	BENZOIC ACID	A,B	2O02	0.75
BEZ	BENZOIC ACID	A,B	2VJ1	0.75
BEZ	BENZOIC ACID	A,B,C	1WSP	0.75
BEZ	BENZOIC ACID	A	1HZ4	0.75
BEZ	BENZOIC ACID	A	2Q38	0.75
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.75
BEZ	BENZOIC ACID	A,B	2QL8	0.75
BEZ	BENZOIC ACID	A	2Q0I	0.75
BEZ	BENZOIC ACID	A,B	1S8F	0.75
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I	1ONI	0.75
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.75
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.75
BEZ	BENZOIC ACID	A,B	2F78	0.75
BEZ	BENZOIC ACID	A,B	2VL2	0.75
BEZ	BENZOIC ACID	A	1HD2	0.75
BEZ	BENZOIC ACID	A	1JU4	0.75
BEZ	BENZOIC ACID	H,L	2AJY	0.75
BEZ	BENZOIC ACID	A,B,C	3GV1	0.75
BEZ	BENZOIC ACID	A	2Q6U	0.75
BEZ	BENZOIC ACID	A,B	1VE9	0.75
BEZ	BENZOIC ACID	A,B	1S9A	0.75
BEZ	BENZOIC ACID	H,L,M	1OP3	0.75
BEZ	BENZOIC ACID	A	1W9E	0.75
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.75
BEZ	BENZOIC ACID	H,L	2AK1	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	2V41	0.75
BEZ	BENZOIC ACID	A,B	1GYX	0.75
BEZ	BENZOIC ACID	A	1V1T	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1YAJ	0.75
BEZ	BENZOIC ACID	A,B	1HKQ	0.75
BEZ	BENZOIC ACID	H,L	1RUK	0.75
BEZ	BENZOIC ACID	A	2Q1B	0.75
BEZ	BENZOIC ACID	H,L	1RUM	0.75
BEZ	BENZOIC ACID	A,B	2F7A	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1KIF	0.75
BEZ	BENZOIC ACID	A,B	2V7B	0.75
BEZ	BENZOIC ACID	H	1NCW	0.75
BEZ	BENZOIC ACID	A,B	1TMX	0.75
BEZ	BENZOIC ACID	A	1URM	0.75
BEZ	BENZOIC ACID	A	1W9O	0.75
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.75
BEZ	BENZOIC ACID	H	1RUP	0.75
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.75
BEZ	BENZOIC ACID	A	2Q9R	0.75
BEZ	BENZOIC ACID	D,H	2OK6	0.75
BEZ	BENZOIC ACID	A,B	2Q0J	0.75
MQ7	MENAQUINONE-7	C,H,L,M	1PRC	0.72
MQ7	MENAQUINONE-7	A,B,D,M,N,P	2B76	0.72
MQ7	MENAQUINONE-7	C,H,L,M	5PRC	0.72
MQ7	MENAQUINONE-7	C,H,L,M	7PRC	0.72
MQ7	MENAQUINONE-7	C,H,L,M	2PRC	0.72
MQ7	MENAQUINONE-7	C,H,L,M	1R2C	0.72
MQ7	MENAQUINONE-7	A,B,C,E,F,G	2VPW	0.72
MQ7	MENAQUINONE-7	C,H,L,M	3PRC	0.72
MQ7	MENAQUINONE-7	A,B,D,M,N,O,P	1L0V	0.72
MQ7	MENAQUINONE-7	C,H,L,M	2JBL	0.72
MQ7	MENAQUINONE-7	C,H,L,M	6PRC	0.72
RWF	R-WARFARIN	A,B	2BXD	0.75
DMW	2,3-DIMETHYL-1,4-NAPHTHOQUINONE	A,B,C,D,E,F	2BS4	0.7
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDL	0.75
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDK	0.75
4FC		A	1YSG	0.79
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.75
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.75
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.75
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.75
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.72
FLP	FLURBIPROFEN	A,B	1CQE	0.72
FLP	FLURBIPROFEN	A,B	1EQH	0.72
FLP	FLURBIPROFEN	A,B	2AYL	0.72
FLP	FLURBIPROFEN	A	1DVT	0.72
FLP	FLURBIPROFEN	A	1R9O	0.72
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.75
MQ9	MENAQUINONE-9	C,H,L,M	3D38	0.72
MQ9	MENAQUINONE-9	C,H,L,M	1VRN	0.72
MQ9	MENAQUINONE-9	C,H,L,M	2I5N	0.72
MQ9	MENAQUINONE-9	C,H,L,M,U	1DXR	0.72
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.78
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE	A	6UPJ	0.76
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.79
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.79
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.79
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.73
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.74
TRZ	TRAZEOLIDE	A	1C12	0.71
PHT	PHTHALIC ACID	A,B,C	2B7P	0.76
PHT	PHTHALIC ACID	A	3C2V	0.76
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.76
PHT	PHTHALIC ACID	A,B	3C2R	0.76
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.74
NLA	NAPHTHALEN-1-YL-ACETIC ACID	A,B,C,D	1LRH	0.71
NLA	NAPHTHALEN-1-YL-ACETIC ACID	B	2P1O	0.71
MQ8	MENAQUINONE 8	C,H,L,M	1EYS	0.72
PIC	6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE- 2-CARBOXYLIC ACID	A	1BZJ	0.71
PMA	PYROMELLITIC ACID	A,B	1FUP	0.73
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.76
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.74
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.74
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE]	A	2Z9C	0.74
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE]	A,B	1OOQ	0.74
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE]	A,B,C,D,E,F, G,H	2F1O	0.74
DIC	3,4-DICHLOROISOCOUMARIN	A	1DIC	0.78
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.72
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.72
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.72
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.72
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.72
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.72
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.72
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.72
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.71
IBP	IBUPROFEN	A	3FKX	0.72
IBP	IBUPROFEN	A,B	2BXG	0.72
IBP	IBUPROFEN	A,B	1EQG	0.72
IBP	IBUPROFEN	A,B,C	2WD9	0.72
IBP	IBUPROFEN	A	2PWS	0.72
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.74
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.86
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.75
PQN	PHYLLOQUINONE	A,B,C,F,I,J, K,L,M,X	1JB0	0.72
PQN	PHYLLOQUINONE	1,2,3,4,A,B, C,F,G,H,I,J, K,L	2O01	0.72
PQN	PHYLLOQUINONE	A,B,C,F,K,L	2PPS	0.72
PQN	PHYLLOQUINONE	A,B,C,F,K,L	1C51	0.72
PQN	PHYLLOQUINONE	0,1,2,3,4,5, 6,7,8,9,A,B, C,F,G,H,J,K, L,P,Q,R,U,V, W,Z	1QZV	0.72
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.74
LEG	1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE	A,B	2PIN	0.7
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.74
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.73
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.73
BHF	2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE	A	2HI4	0.71
FBC		A,B	2B9A	0.78
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID	A	1MVC	0.8
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID	A,C,E,G	1MZN	0.8
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.77
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.77
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.81
9TA	1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE	A,B	1FDG	0.71
OX1		H,Y	1LO2	0.73
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.7
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.75
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.75
HPK	(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE	A	2PUH	0.72
VII	2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID	A,B	2GFK	0.71
VK3	MENADIONE	A	1TUV	0.7
VK3	MENADIONE	A,B	2QR2	0.7
MBO	MERCURIBENZOIC ACID	A	2QO8	0.75
MBO	MERCURIBENZOIC ACID	A	1LUG	0.75
MBO	MERCURIBENZOIC ACID	A	2HOC	0.75
MBO	MERCURIBENZOIC ACID	A	3EFI	0.75
MBO	MERCURIBENZOIC ACID	A	3BL0	0.75
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.75
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.75
MBO	MERCURIBENZOIC ACID	A	1DR7	0.75
MBO	MERCURIBENZOIC ACID	A	2HL4	0.75
MBO	MERCURIBENZOIC ACID	A	2GD8	0.75
MBO	MERCURIBENZOIC ACID	A	2QP6	0.75
MBO	MERCURIBENZOIC ACID	A	2HD6	0.75
MBO	MERCURIBENZOIC ACID	A	3C7P	0.75
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.75
MBO	MERCURIBENZOIC ACID	A	1DR6	0.75
MBO	MERCURIBENZOIC ACID	A	2HNC	0.75
MBO	MERCURIBENZOIC ACID	A	2QOA	0.75
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.71
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.71
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.82
SWF	S-WARFARIN	A,B	1OG5	0.75
201	3-AMIDO-5-BIPHENYL-BENZOIC ACID	A	2B0M	0.71
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE	B	5UPJ	0.76
26C		A,B	2F7I	0.78
BZQ	DIPHENYLMETHANONE	A,B	1GT5	0.72
BZQ	DIPHENYLMETHANONE	A,B	1DZP	0.72
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.74
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.79
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID	A,B	2GH5	0.77
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.7
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.82
BFL		A,B	1Q4G	0.74
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID	L	1FLR	0.7
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID	A,B	1N0S	0.7
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID	C,L	1T66	0.7
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID	A	1X9Q	0.7
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID	A,D	2NMV	0.7