MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02257018

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Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
F79	2-(2-AMINOETHOXY)-3-ETHYL-6-{[(4- FLUOROPHENYL)SULFONYL]AMINO}BENZOIC ACID	A	2EA4	0.73
DMB		A,B	1SRI	0.77
NAB		A,B	1SRJ	0.72
ZHZ	2-(4-METHOXYPHENYL)ACETAMIDE	D,H	2HKR	0.7
OFL	O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID	A	1DVZ	0.72
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.79
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.79
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.79
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.79
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.79
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.79
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.79
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.79
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.79
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.79
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.79
FNG	5-AMINOCARBONYL-3-NITROPHENYL-ALPHA- D-GALACTOPYRANOSE	D,E,F,G,H	1LLR	0.71
TYQ	3-AMINO-6-HYDROXY-TYROSINE	A,B	1D6Y	0.7
TYQ	3-AMINO-6-HYDROXY-TYROSINE	A,B	1D6U	0.7
ICU	METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE	A	1JIM	0.75
A41	5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID	A	1YW7	0.71
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	A,B,C,D,I,J, K,L	3EWF	0.77
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	A,B,I,L	2V5W	0.77
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	B	1VDN	0.77
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	C	1VAI	0.77
617	2-{[(4-CHLOROPHENOXY)ACETYL]AMINO}BENZOIC ACID	A	2QE5	0.74
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.72
DPA		A,B	1PIK	0.75
D27	2-{[(2E)-3-(3,4-dimethoxyphenyl)prop- 2-enoyl]amino}benzoic acid	A,B,C,D	2VD0	0.8
PX1	(1Z)-7-AMINO-1-(HYDROXYMETHYLENE)- 2-IMINO-4,6-DIMETHYL-3-OXO-2,3- DIHYDRO-1H-PHENOXAZINE-9-CARBALDEHYDE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	1UNJ	0.72
PX1	(1Z)-7-AMINO-1-(HYDROXYMETHYLENE)- 2-IMINO-4,6-DIMETHYL-3-OXO-2,3- DIHYDRO-1H-PHENOXAZINE-9-CARBALDEHYDE	A,B,C,D,E,F	1UNM	0.72
MTJ	N,O-DIMETHYL-L-TYROSINE	A,B	1ATL	0.7
MHB		A,B	1SRG	0.79
VNL	4-HYDROXY-3-METHOXYBENZOATE	A,B,C,D	2AHC	0.7
VNL	4-HYDROXY-3-METHOXYBENZOATE	A	1XLR	0.7
MOB		A,B	1SRH	0.84
B23	5-(2-NITROPHENYL)-2-FUROIC ACID	A	2Q92	0.76
D55	4-(2-aminoethoxy)-N-(2,5-diethoxyphenyl)- 3,5-dimethylbenzamide	A	2VIQ	0.72
MTB		A,B	1SRF	0.75
OBA	2-(OXALYL-AMINO)-BENZOIC ACID	A	1C85	0.7
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.75
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.75
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.78
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.78
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.78
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.78
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.78
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.71
BN5	5-[3-({[(2,4-DICHLOROBENZOYL)AMINO]CARBONYL}AMINO)- 2-METHYLPHENOXY]PENTANOIC ACID	A	1WV1	0.72
DMC	3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID	G	4GCH	0.71
RAC	4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)- BENZOIC ACID	H	1MEX	0.7
BRK	{(2Z)-4-AMINO-2-[(4-METHOXYPHENYL)IMINO]- 2,3-DIHYDRO-1,3-THIAZOL-5-YL}(4- METHOXYPHENYL)METHANONE	A	2IZR	0.71
R6G	RHODAMINE 6G	B	2V3L	0.71
OXI	OXOLINIC ACID	A,B	1KSE	0.72
296	(3R)-3-amino-2,2-difluoro-3-(4- methoxyphenyl)propanoic acid	A,B	2RJS	0.76
R2C	5-METHOXY-2-[(4-PHENOXYPHENYL)AMINO]BENZOIC ACID	A	2PRL	0.78
ACJ	5-[2-CHLORO-4-(TRIFLUOROMETHYL)PHENOXY]- 2-NITROBENZOIC ACID	A,B	2IVD	0.7
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.77
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.77
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.75
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.75
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.75
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.75
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.75
SX1	2-amino-5-bromobenzoic acid	A,B	3CIZ	0.73
RDE	2-(3-AMINO-2,5,6-TRIMETHOXYPHENYL)ETHYL 5- CHLORO-2,4-DIHYDROXYBENZOATE	A,B	2FYP	0.71
RDE	2-(3-AMINO-2,5,6-TRIMETHOXYPHENYL)ETHYL 5- CHLORO-2,4-DIHYDROXYBENZOATE	A	1ZWH	0.71
44C		A	2FBR	0.75
VXX	VANILLATE	A,B	1WB6	0.71
MR2	3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN- 1-ONE	A	1TSM	0.7
NRO	3-[5-(2-nitropent-1-en-1-yl)furan- 2-yl]benzoic acid	A,B	2ZK5	0.71
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.71
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.71
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.71
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A,B	1BM7	0.72
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	1S2C	0.72
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	2PIX	0.72
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.74
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.74
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.74
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.74
SCL	ACETIC ACID SALICYLOYL-AMINO-ESTER	A	1EBV	0.7
HV7	1-METHYLAMINE-2-HYDROXY-4-METHOXY- BENZENE	C	1A8G	0.7
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.73
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.71
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBC	0.79
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBF	0.79
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1SXK	0.79
IC1	3-[(2,4,6-TRIMETHOXY-PHENYL)-METHYLENE]- INDOLIN-2-ONE	A,B	1EH4	0.71
6CA		A	2FLM	0.75
HBD	4-HYDROXYBENZAMIDE	B,C,D	1BEN	0.72
3MB	3-METHOXYBENZAMIDE	A	3PAX	0.73
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.73
3FT		A	2BXV	0.7
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.71
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.72
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.7
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.7
HAB		A,B	1SRE	0.79
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.76