MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02497045

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
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.77
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	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	0.84
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	0.84
DIC	3,4-DICHLOROISOCOUMARIN	A	1DIC	0.73
MBO	MERCURIBENZOIC ACID	A	2QO8	0.71
MBO	MERCURIBENZOIC ACID	A	1LUG	0.71
MBO	MERCURIBENZOIC ACID	A	2HOC	0.71
MBO	MERCURIBENZOIC ACID	A	3EFI	0.71
MBO	MERCURIBENZOIC ACID	A	3BL0	0.71
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.71
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.71
MBO	MERCURIBENZOIC ACID	A	1DR7	0.71
MBO	MERCURIBENZOIC ACID	A	2HL4	0.71
MBO	MERCURIBENZOIC ACID	A	2GD8	0.71
MBO	MERCURIBENZOIC ACID	A	2QP6	0.71
MBO	MERCURIBENZOIC ACID	A	2HD6	0.71
MBO	MERCURIBENZOIC ACID	A	3C7P	0.71
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.71
MBO	MERCURIBENZOIC ACID	A	1DR6	0.71
MBO	MERCURIBENZOIC ACID	A	2HNC	0.71
MBO	MERCURIBENZOIC ACID	A	2QOA	0.71
FBC		A,B	2B9A	0.76
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.7
FLP	FLURBIPROFEN	A,B	1CQE	0.7
FLP	FLURBIPROFEN	A,B	1EQH	0.7
FLP	FLURBIPROFEN	A,B	2AYL	0.7
FLP	FLURBIPROFEN	A	1DVT	0.7
FLP	FLURBIPROFEN	A	1R9O	0.7
SMN	(S)-MANDELIC ACID	A	1MDL	0.7
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE	B	5UPJ	0.74
PHT	PHTHALIC ACID	A,B,C	2B7P	0.71
PHT	PHTHALIC ACID	A	3C2V	0.71
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.71
PHT	PHTHALIC ACID	A,B	3C2R	0.71
COC	COCAINE	A,C	1I7Z	0.71
COC	COCAINE	H	1Q72	0.71
COC	COCAINE	L	2AJV	0.71
COC	COCAINE	A,B,C,D,E	2PGZ	0.71
CIO	CILOMILAST	A,B	1XOM	0.72
CIO	CILOMILAST	A,B	1XLX	0.72
26C		A,B	2F7I	0.76
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.76
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.7
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID	A,B	2GH5	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.7
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
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.71
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.71
ENM	(5S,8R,9S,10S,13R,14S,17S)-13-{2- [(3,5-DIFLUOROBENZYL)OXY]ETHYL}- 17-HYDROXY-10-METHYLHEXADECAHYDRO- 3H-CYCLOPENTA[A]PHENANTHREN-3-ONE	A	2PNU	0.75
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.75
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.74
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.74
4FC		A	1YSG	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	0.79
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.83
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.76
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.71
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.71
BFL		A,B	1Q4G	0.72
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.79
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.73
BEZ	BENZOIC ACID	A,B	2F8D	0.71
BEZ	BENZOIC ACID	A,B	1A8U	0.71
BEZ	BENZOIC ACID	A,B	1REE	0.71
BEZ	BENZOIC ACID	A	1L7Q	0.71
BEZ	BENZOIC ACID	A	1I69	0.71
BEZ	BENZOIC ACID	H,L	1RUL	0.71
BEZ	BENZOIC ACID	A,B	3CCF	0.71
BEZ	BENZOIC ACID	A	1W9Q	0.71
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.71
BEZ	BENZOIC ACID	H,L	1RUA	0.71
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1H4O	0.71
BEZ	BENZOIC ACID	H,L	1RU9	0.71
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.71
BEZ	BENZOIC ACID	A	2QMQ	0.71
BEZ	BENZOIC ACID	A	1UKB	0.71
BEZ	BENZOIC ACID	A,B	1RED	0.71
BEZ	BENZOIC ACID	A,B	1OC3	0.71
BEZ	BENZOIC ACID	A,B	1REF	0.71
BEZ	BENZOIC ACID	A,B	2O02	0.71
BEZ	BENZOIC ACID	A,B	2VJ1	0.71
BEZ	BENZOIC ACID	A,B,C	1WSP	0.71
BEZ	BENZOIC ACID	A	1HZ4	0.71
BEZ	BENZOIC ACID	A	2Q38	0.71
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.71
BEZ	BENZOIC ACID	A,B	2QL8	0.71
BEZ	BENZOIC ACID	A	2Q0I	0.71
BEZ	BENZOIC ACID	A,B	1S8F	0.71
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.71
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I	1ONI	0.71
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.71
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.71
BEZ	BENZOIC ACID	A,B	2F78	0.71
BEZ	BENZOIC ACID	A,B	2VL2	0.71
BEZ	BENZOIC ACID	A	1HD2	0.71
BEZ	BENZOIC ACID	A	1JU4	0.71
BEZ	BENZOIC ACID	H,L	2AJY	0.71
BEZ	BENZOIC ACID	A,B,C	3GV1	0.71
BEZ	BENZOIC ACID	A	2Q6U	0.71
BEZ	BENZOIC ACID	A,B	1VE9	0.71
BEZ	BENZOIC ACID	A,B	1S9A	0.71
BEZ	BENZOIC ACID	H,L,M	1OP3	0.71
BEZ	BENZOIC ACID	A	1W9E	0.71
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.71
BEZ	BENZOIC ACID	H,L	2AK1	0.71
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	2V41	0.71
BEZ	BENZOIC ACID	A,B	1GYX	0.71
BEZ	BENZOIC ACID	A	1V1T	0.71
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1YAJ	0.71
BEZ	BENZOIC ACID	A,B	1HKQ	0.71
BEZ	BENZOIC ACID	H,L	1RUK	0.71
BEZ	BENZOIC ACID	A	2Q1B	0.71
BEZ	BENZOIC ACID	H,L	1RUM	0.71
BEZ	BENZOIC ACID	A,B	2F7A	0.71
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1KIF	0.71
BEZ	BENZOIC ACID	A,B	2V7B	0.71
BEZ	BENZOIC ACID	H	1NCW	0.71
BEZ	BENZOIC ACID	A,B	1TMX	0.71
BEZ	BENZOIC ACID	A	1URM	0.71
BEZ	BENZOIC ACID	A	1W9O	0.71
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.71
BEZ	BENZOIC ACID	H	1RUP	0.71
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.71
BEZ	BENZOIC ACID	A	2Q9R	0.71
BEZ	BENZOIC ACID	D,H	2OK6	0.71
BEZ	BENZOIC ACID	A,B	2Q0J	0.71
S1A	SORAPHEN A	A,B	3GID	0.71
S1A	SORAPHEN A	A,B,C	1W96	0.71
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.71
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.71
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.71
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.71
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.71
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.71
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE	A	6UPJ	0.74
ODE	DIETHYL (1R,2S,3R,4S)-5,6-BIS(4- HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT- 5-ENE-2,3-DICARBOXYLATE	A,B	2QH6	0.72
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
MUF	(8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid	A,B	3BEJ	0.72
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.7
HZ3	dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate	A,B	2QR9	0.73
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.74
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.74
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.71
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.71
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.71
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.71
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.71
L79	(S)-(2E)-3[4-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-2-NAPHTHALENYL)TETRAHYDRO- 1-BENZOFURAN-2-YL]-2-PROPENOIC ACID	A,D	1RDT	0.78
TRZ	TRAZEOLIDE	A	1C12	0.75
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.74
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.74
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.74
RMN	(R)-MANDELIC ACID	A	1MDL	0.7
RMN	(R)-MANDELIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1MCZ	0.7