MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02334225

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
GF7	(3S)-1-(4-acetylphenyl)-5-oxopyrrolidine- 3-carboxylic acid	A	3GQZ	0.72
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.7
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE	A,B	1T47	0.72
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.71
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.71
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.71
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.71
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.71
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.71
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.71
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.71
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.71
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.71
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.71
53N	3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid	A	3DN5	0.72
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.74
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.74
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.74
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.73
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.83
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.82
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.85
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
KYN	KYNURENINE	A,B,C,D	2R2N	0.78
KYN	KYNURENINE	A,B	3E2Z	0.78
KYN	KYNURENINE	A	1XT7	0.78
KYN	KYNURENINE	A	1T5M	0.78
KYN	KYNURENINE	A	1T5N	0.78
KYN	KYNURENINE	A	2VOV	0.78
KYN	KYNURENINE	A	2VOX	0.78
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.72
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.72
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.72
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.72
IBR		A	9EST	0.72
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.84
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.76
NID	4-NITRO-INDEN-1-ONE	A,B	1DOH	0.8
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.71
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.73
AAH		H	1KEL	0.72
AAH		B,H	1FL6	0.72