MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01379749

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
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D	3E5U	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B	3E6B	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D	3E5X	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B	2H6B	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	C	3E6C	0.72
CHB	3-CHLORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCH	0.79
4FE	(2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid	A	3CBG	0.76
113	7,8-DIHYDROXY-1-METHOXY-3-METHYL- 10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3- B]CHROMENE-9-CARBOXYLIC ACID	A,B	1KR3	0.72
113	7,8-DIHYDROXY-1-METHOXY-3-METHYL- 10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3- B]CHROMENE-9-CARBOXYLIC ACID	A,B	1HLK	0.72
C17	7-[(3-CHLOROBENZYL)OXY]-2-OXO-2H- CHROMENE-4-CARBALDEHYDE	A,B	2V60	0.73
EAA	ETHACRYNIC ACID	A,B	3DGQ	0.82
EAA	ETHACRYNIC ACID	A,B	11GS	0.82
EAA	ETHACRYNIC ACID	A,B,C,D	1GSF	0.82
EAA	ETHACRYNIC ACID	A,B	2GSS	0.82
EAA	ETHACRYNIC ACID	A,B	3GSS	0.82
EAA	ETHACRYNIC ACID	A,B	1GSE	0.82
B21	5-(2-METHOXYPHENYL)-2-FUROIC ACID	A	2Q93	0.73
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	M,N,O,P,Q,R	3PCN	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	B	1AI4	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B,C,D	1Q0C	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B	1F1V	0.72
A15	3'-3"-DICHLOROPHENOL-1,8-3H-BENZO[DE]ISOCHROMEN- 1-ONE	A	1TSL	0.73
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.79
34C	(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID	A,B	1HT8	0.81
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.77
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.77
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.77
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.77
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.77
C2U	3,5-dichloro-2-hydroxybenzoic acid	A	3C3U	0.7
C2U	3,5-dichloro-2-hydroxybenzoic acid	A	3CV7	0.7
8CM	8-HYDROXYCOUMARIN	A	2H8Z	0.72
A18	5-(2-CHLOROBENZYL)-2-FUROIC ACID	A	2Q96	0.78
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE	A	1GP5	0.72
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE	A	1GP6	0.72
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BV0	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B,D,F,H,J,L	1YKP	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1N8Q	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B	2BSL	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKL	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D	1B4U	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	A	3DX5	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCA	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKN	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	B	1EOB	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1PHH	0.76
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BUV	0.76
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE	A	1GP5	0.72
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE	D,F	2C29	0.72
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.72
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.72
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.72
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.72
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.72
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.72
300	2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE	A	1O41	0.7