MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03205361

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
PID	PERIDININ	A	2C9E	0.71
PID	PERIDININ	M,N,O	1PPR	0.71
DL4	(14beta,17alpha,25R)-3-oxocholest- 4-en-26-oic acid	A	3GYT	0.75
DGX	DIGOXIN	B,D	1IGJ	0.73
TES	TESTOSTERONE	A	1JTV	0.78
TES	TESTOSTERONE	A	2Q7L	0.78
TES	TESTOSTERONE	A	2Q7I	0.78
TES	TESTOSTERONE	A,B	1J96	0.78
TES	TESTOSTERONE	A	2Q7K	0.78
TES	TESTOSTERONE	A,B	1Q13	0.78
TES	TESTOSTERONE	H	1I9J	0.78
TES	TESTOSTERONE	A,B	1AFS	0.78
TES	TESTOSTERONE	H	1VPO	0.78
TES	TESTOSTERONE	A	2Q7J	0.78
TES	TESTOSTERONE	A,B	3BUR	0.78
TES	TESTOSTERONE	A	2AM9	0.78
OBN	OUABAIN	H,L	1IBG	0.76
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	A,D	1R1K	0.82
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,U	1Z5X	0.82
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,F,G,H	2NXX	0.82
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.81
NOG	13-BETA-ETHYL-17-ALPHA-ETHYNYL- 17-BETA-HYDROXYGON-4-EN-3-ONE	A	1LHV	0.72
NOG	13-BETA-ETHYL-17-ALPHA-ETHYNYL- 17-BETA-HYDROXYGON-4-EN-3-ONE	A,B	3D90	0.72
GR4		H,I	1AWF	0.75
NDR	(14beta,17alpha)-17-ethynyl-17- hydroxyestr-4-en-3-one	A,B	1SQN	0.72
NDR	(14beta,17alpha)-17-ethynyl-17- hydroxyestr-4-en-3-one	A,B	2W8Y	0.72
C0R	CORTICOSTERONE	A	2A3I	0.79
C0R	CORTICOSTERONE	A,B	1Y5R	0.79
PRB	13-ACETYLPHORBOL	A	1PTR	0.71
1CA	DESOXYCORTICOSTERONE	A,B	1Y9R	0.75
1CA	DESOXYCORTICOSTERONE	A,B,C	2ABI	0.75
1CA	DESOXYCORTICOSTERONE	A	2Q3Y	0.75
1CA	DESOXYCORTICOSTERONE	A	2AA7	0.75
WIN	methyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)- 15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}- 3,11,12-trihydroxy-2,16-dioxo-13,20- epoxypicras-3-en-21-oate	0,1,2,3,9,A, B,C,F,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z	3G71	0.75
GA3	GIBBERELLIN A3	A	2ZSH	0.78
GA3	GIBBERELLIN A3	A,B,C,D,E,F	3ED1	0.78
SIM	SIMVASTATIN	A,B,C,D	1HW9	0.72
SNL	SPIRONOLACTONE	A,B	2AB2	0.7
SNL	SPIRONOLACTONE	A,B,C,D,E,F	2OAX	0.7
CBO	CARBENOXOLONE	A,B,C,D	1HDC	0.72
CBO	CARBENOXOLONE	A,B,C,D	2BEL	0.72
20E	(2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one	A,D	2R40	0.82
DTX	DIGITOXIGENIN	A	1LNM	0.86
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPG	0.78
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPJ	0.78
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPF	0.78
GR3	3-ACETOXY-17-(1-FORMYL-5-METHYL- 3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14- TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE- 4-CARBOXYLIC ACID	B,D	1AWH	0.81
CLL	CHOLESTERYL LINOLEATE	A,B	1CLE	0.73
NTH	SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER	A,B	1BUQ	0.8
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A,B	1E3R	0.74
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	3DHE	0.74
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	1J99	0.74
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	1COY	0.74
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	1Q22	0.74
ZK5	9ALPHA-FLUOROCORTISOL	A	1GS4	0.77
B2S	(3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one	A	3B2S	0.7
DEX	DEXAMETHASONE	A,D	1M2Z	0.75
DEX	DEXAMETHASONE	A,B,C,D	1P93	0.75
FUA	FUSIDIC ACID	A	1QCA	0.87
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.87
FUA	FUSIDIC ACID	A,B	2VUF	0.87
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A	3EAU	0.77
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A	3EB3	0.77
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A	3EB4	0.77
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A,B	2AAX	0.77
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A	1H61	0.77
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A,B	3CMF	0.77
PDN	17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE	A	2Q1V	0.77
HCY	(11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione	A,B	2VDY	0.78
HCY	(11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione	A	2V95	0.78
DOG	DIGOXIGENIN	A	1LKE	0.85
PLO	(3BETA)-3-HYDROXYPREGN-5-EN-20- ONE	A	1Q20	0.73
DL7	(5beta,14beta,17alpha,25R)-3-oxocholest- 7-en-26-oic acid	A	3GYU	0.72
AS4	ALDOSTERONE	A	2AA2	0.79
AS4	ALDOSTERONE	A	2Q1H	0.79
CBW	(3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID	A	2W4Q	0.74
GA4	GIBBERELLIN A4	A	2ZSI	0.71
GA4	GIBBERELLIN A4	A,B,C,D,E,F	3EBL	0.71
GA4	GIBBERELLIN A4	H,I	1KFA	0.71
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.79
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.79
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	0.79
2OB	CHOLESTERYL OLEATE	A	2OBD	0.73