MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02212645

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
201	3-AMIDO-5-BIPHENYL-BENZOIC ACID	A	2B0M	0.75
MNY	5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE	A	1M2R	0.71
OBA	2-(OXALYL-AMINO)-BENZOIC ACID	A	1C85	0.73
878	5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID	A	1ECV	0.71
F77	3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID	A	2EA2	0.74
A75	2-[(PHENYLSULFONYL)AMINO]-5,6,7,8- TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID	A	1YW8	0.74
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.88
OFL	O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID	A	1DVZ	0.78
HOP	(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)- 5-PHENYL-1-CYCLOHEXANOL	H,L	1D6V	0.72
HOP	(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)- 5-PHENYL-1-CYCLOHEXANOL	A,B,H,L	1AXS	0.72
761	3-(OXALYL-AMINO)-NAPHTHALENE-2- CARBOXYLIC ACID	A	1C84	0.74
MTB		A,B	1SRF	0.77
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.7
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	1YYL	0.7
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	2I5Y	0.7
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.81
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.81
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.81
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.81
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.71
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3GT4	0.73
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3T	0.73
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3D	0.73
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3S	0.73
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E79	0.73
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.78
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.82
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.82
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.82
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.82
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.82
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.82
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.82
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.82
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.82
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.82
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.82
IDB	3-[5-[(3-CARBOXY-2,4,6-TRIIODO- PHENYL)CARBAMOYL]PENTANOYLAMINO]- 2,4,6-TRIIODO-BENZOIC ACID	A	2BXN	0.72
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3S	0.78
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B,C,D	2H4B	0.78
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.77
SX1	2-amino-5-bromobenzoic acid	A,B	3CIZ	0.76
NAB		A,B	1SRJ	0.74
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.71
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.75
4AF	4-ACETYL-L-PHENYLALANINE	A	1ZH6	0.74
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.78
KYN	KYNURENINE	A,B,C,D	2R2N	0.83
KYN	KYNURENINE	A,B	3E2Z	0.83
KYN	KYNURENINE	A	1XT7	0.83
KYN	KYNURENINE	A	1T5M	0.83
KYN	KYNURENINE	A	1T5N	0.83
KYN	KYNURENINE	A	2VOV	0.83
KYN	KYNURENINE	A	2VOX	0.83
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.71
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.71
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.7
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.74
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.74
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.73
HAB		A,B	1SRE	0.8
A41	5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID	A	1YW7	0.78
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.71
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.71
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.71
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.76
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.76
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A,B	3CFQ	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	1SV9	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	1NR6	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	3HWV	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	B	1DVX	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	2B6D	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A,B,C,D	1PXX	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	2B17	0.73
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
LZQ	4-[3-(dibenzylamino)phenyl]-2,4- dioxobutanoic acid	A	3EB1	0.74
IBR		A	9EST	0.74
DMB		A,B	1SRI	0.8
U14	3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID	A	2GG7	0.74
RAC	4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)- BENZOIC ACID	H	1MEX	0.71
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A,B	1BM7	0.78
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	1S2C	0.78
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	2PIX	0.78
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.73
MHB		A,B	1SRG	0.78
4BA	4-[(2-CARBOXY-ETHYLAMINO)-METHYL]- BENZOIC ACID	C	1FAV	0.71
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.77
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.77
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.77
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.77
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.77
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.77
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FR9	0.77
PBF	PARA-(BENZOYL)-PHENYLALANINE	A,B	1EEN	0.77
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2HGZ	0.77
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FRB	0.77
A80	N-(5,5,8,8-TETRAMETHYL-5,8-DIHYDRO- NAPHTHALEN-2-YL)-TEREPHTHALAMIC ACID	A	2CBR	0.72