MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02337775

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
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.72
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.71
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.74
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.79
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.76
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.76
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.76
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.76
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.72
961	3-FLUORO-4-[2-HYDROXY-2-(5,5,8,8- TETRAMETHYL-5,6,7,8,-TETRAHYDRO- NAPHTALEN-2-YL)-ACETYLAMINO]-BENZOIC ACID	A	4LBD	0.74
961	3-FLUORO-4-[2-HYDROXY-2-(5,5,8,8- TETRAMETHYL-5,6,7,8,-TETRAHYDRO- NAPHTALEN-2-YL)-ACETYLAMINO]-BENZOIC ACID	A	1EXX	0.74
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.82
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.82
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.82
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.82
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.82
RAC	4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)- BENZOIC ACID	H	1MEX	0.73
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3S	0.74
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B,C,D	2H4B	0.74
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.72
A80	N-(5,5,8,8-TETRAMETHYL-5,8-DIHYDRO- NAPHTHALEN-2-YL)-TEREPHTHALAMIC ACID	A	2CBR	0.76
MTB		A,B	1SRF	0.73
F77	3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID	A	2EA2	0.72
2UN	{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)- 3-OXOPROPYL]PHENYL}SULFAMIC ACID	A,B	2H02	0.75
RXB	(1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo- 1,2,3,4-tetrahydroisoquinolin-5- yl)amino]ethyl acetate	A,B,C,D	3DEI	0.7
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.76
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.76
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.77
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.77
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.77
UC3	1-METHYL ETHYL 2-CHLORO-5-[[[(1- METHYLETHOXY)THIOOXO]METHYL]AMINO]- BENZOATE	A	1RT6	0.72
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBC	0.72
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBF	0.72
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1SXK	0.72
RBE	3-(BENZOYLOXY)-8-AZA-BICYCLO[3.2.1]OCTANE- 2-CARBOXYLIC ACID	H	1RIU	0.7
A41	5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID	A	1YW7	0.72
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	A,B,C,D,I,J, K,L	3EWF	0.71
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	A,B,I,L	2V5W	0.71
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	B	1VDN	0.71
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	C	1VAI	0.71
ST6	4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID	A,B	1INH	0.71
IBR		A	9EST	0.78
OFL	O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID	A	1DVZ	0.71
AAF	METHYL 4-{[({[(2R,5S)-5-{[(2S)- 2-(AMINOMETHYL)PYRROLIDIN-1-YL]CARBONYL}PYRROLIDIN- 2-YL]METHYL}AMINO)CARBONYL]AMINO}BENZOATE	B	2G63	0.71
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.74
394	R-3-FLUORO-4-[2-HYDROXY-2-(5,5,8,8- TETRAMETHYL-5,6,7,8,-TETRAHYDRO- NAPHTALEN-2-YL)-ACETYLAMINO]-BENZOIC ACID	A	1EXA	0.74
FDI	4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID	A	1B9S	0.74
COC	COCAINE	A,C	1I7Z	0.7
COC	COCAINE	H	1Q72	0.7
COC	COCAINE	L	2AJV	0.7
COC	COCAINE	A,B,C,D,E	2PGZ	0.7
ICU	METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE	A	1JIM	0.79
201	3-AMIDO-5-BIPHENYL-BENZOIC ACID	A	2B0M	0.71
GBS	4-GUANIDINOBENZOIC ACID	X	2AH4	0.73
GBS	4-GUANIDINOBENZOIC ACID	A	1GBT	0.73
GBS	4-GUANIDINOBENZOIC ACID	A	1RTK	0.73
GBS	4-GUANIDINOBENZOIC ACID	A	3DFL	0.73
ST5	4-(ACETYLAMINO)-3-[(HYDROXYACETYL)AMINO]BENZOIC ACID	A,B	1ING	0.71
A75	2-[(PHENYLSULFONYL)AMINO]-5,6,7,8- TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID	A	1YW8	0.71
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A,B	1BM7	0.7
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	1S2C	0.7
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	2PIX	0.7
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.75
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.75
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.75
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.75
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.75
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.75
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.75
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.75
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.75
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.75
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.75
MAZ	FORMIC ACID 3-AMINO-BENZYL ESTER	H,L	1JYQ	0.74
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.72
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.71
ST3	4-(ACETYLAMINO)-3-AMINO BENZOIC ACID	A,B	1IVE	0.73