MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03241686

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
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.71
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.74
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.75
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.75
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3S	0.75
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B,C,D	2H4B	0.75
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.73
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3GT4	0.74
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3T	0.74
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3D	0.74
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3S	0.74
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E79	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A,B	3CFQ	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	1SV9	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	1NR6	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	3HWV	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	B	1DVX	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	2B6D	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A,B,C,D	1PXX	0.71
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	2B17	0.71
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.73
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.73
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.73
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.8
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.8
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.8
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.8
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.8
IBR		A	9EST	0.76
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.75
ST3	4-(ACETYLAMINO)-3-AMINO BENZOIC ACID	A,B	1IVE	0.71
4AF	4-ACETYL-L-PHENYLALANINE	A	1ZH6	0.72
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.72
ICU	METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE	A	1JIM	0.73
NAB		A,B	1SRJ	0.7
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.72
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.72
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.72
878	5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID	A	1ECV	0.8
IDB	3-[5-[(3-CARBOXY-2,4,6-TRIIODO- PHENYL)CARBAMOYL]PENTANOYLAMINO]- 2,4,6-TRIIODO-BENZOIC ACID	A	2BXN	0.72
MTB		A,B	1SRF	0.73
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.76
DMB		A,B	1SRI	0.74
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FR9	0.71
PBF	PARA-(BENZOYL)-PHENYLALANINE	A,B	1EEN	0.71
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2HGZ	0.71
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FRB	0.71
OBA	2-(OXALYL-AMINO)-BENZOIC ACID	A	1C85	0.78
ISN	ISATIN	A,B	1OJA	0.72
ISN	ISATIN	A,B	2BK5	0.72
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.73
A75	2-[(PHENYLSULFONYL)AMINO]-5,6,7,8- TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID	A	1YW8	0.7
HAB		A,B	1SRE	0.77
SX1	2-amino-5-bromobenzoic acid	A,B	3CIZ	0.79
F77	3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID	A	2EA2	0.7
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A,B	1BM7	0.76
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	1S2C	0.76
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	2PIX	0.76
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.73
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.73
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.73
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.73
GBS	4-GUANIDINOBENZOIC ACID	X	2AH4	0.7
GBS	4-GUANIDINOBENZOIC ACID	A	1GBT	0.7
GBS	4-GUANIDINOBENZOIC ACID	A	1RTK	0.7
GBS	4-GUANIDINOBENZOIC ACID	A	3DFL	0.7
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.75
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.81
OFL	O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID	A	1DVZ	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.86
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.86
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.86
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.86
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.86
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.86
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.86
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.86
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.86
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.86
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.86
MHB		A,B	1SRG	0.75
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBC	0.71
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBF	0.71
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1SXK	0.71
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.72
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.72
A41	5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID	A	1YW7	0.74
761	3-(OXALYL-AMINO)-NAPHTHALENE-2- CARBOXYLIC ACID	A	1C84	0.71
U14	3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID	A	2GG7	0.75
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.84
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.84
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.84
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.84
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.89
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.73
KYN	KYNURENINE	A,B,C,D	2R2N	0.84
KYN	KYNURENINE	A,B	3E2Z	0.84
KYN	KYNURENINE	A	1XT7	0.84
KYN	KYNURENINE	A	1T5M	0.84
KYN	KYNURENINE	A	1T5N	0.84
KYN	KYNURENINE	A	2VOV	0.84
KYN	KYNURENINE	A	2VOX	0.84
LZQ	4-[3-(dibenzylamino)phenyl]-2,4- dioxobutanoic acid	A	3EB1	0.73
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.75
PRQ	(3S)-3-amino-3-(2-nitrophenyl)propanoic acid	C,F,I,L	2VE6	0.71