MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02147101

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
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.8
IBR		A	9EST	0.76
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.72
PRQ	(3S)-3-amino-3-(2-nitrophenyl)propanoic acid	C,F,I,L	2VE6	0.75
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
23N	(2R)-2-benzyl-3-nitropropanoic acid	A	2RFH	0.7
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.83
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
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE	A,B	1T47	0.75
53N	3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid	A	3DN5	0.75
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.82
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.71
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.71
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.71
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.71
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.71
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.73
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.75
3NT	3-NITROTOLUENE	A,B	2BMR	0.7
3NT	3-NITROTOLUENE	A,B	2HMO	0.7
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.78
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.78
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.75
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.75
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.75
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.75
NID	4-NITRO-INDEN-1-ONE	A,B	1DOH	0.83
KYN	KYNURENINE	A,B,C,D	2R2N	0.74
KYN	KYNURENINE	A,B	3E2Z	0.74
KYN	KYNURENINE	A	1XT7	0.74
KYN	KYNURENINE	A	1T5M	0.74
KYN	KYNURENINE	A	1T5N	0.74
KYN	KYNURENINE	A	2VOV	0.74
KYN	KYNURENINE	A	2VOX	0.74