MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02648730

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
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.72
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.72
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.72
DMB		A,B	1SRI	0.72
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.76
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.74
HAB		A,B	1SRE	0.74
OBA	2-(OXALYL-AMINO)-BENZOIC ACID	A	1C85	0.74
OFL	O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID	A	1DVZ	0.75
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.72
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.72
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.75
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
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A,B	1BM7	0.74
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	1S2C	0.74
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	2PIX	0.74
MHB		A,B	1SRG	0.73
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.78
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.78
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.78
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.78
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.71
878	5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID	A	1ECV	0.73
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.84
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.84
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.84
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.84
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.84
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.84
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.84
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.84
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.84
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.84
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.84
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.7
KYN	KYNURENINE	A,B,C,D	2R2N	0.73
KYN	KYNURENINE	A,B	3E2Z	0.73
KYN	KYNURENINE	A	1XT7	0.73
KYN	KYNURENINE	A	1T5M	0.73
KYN	KYNURENINE	A	1T5N	0.73
KYN	KYNURENINE	A	2VOV	0.73
KYN	KYNURENINE	A	2VOX	0.73
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.73
A41	5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID	A	1YW7	0.73