MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03918844

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
CA4	CYPROTERONE ACETATE	A	2OZ7	0.7
DEX	DEXAMETHASONE	A,D	1M2Z	0.82
DEX	DEXAMETHASONE	A,B,C,D	1P93	0.82
0AS	asiatic acid	A	2QN1	0.75
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPG	0.81
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPJ	0.81
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPF	0.81
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	A,D	1R1K	0.8
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,U	1Z5X	0.8
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,F,G,H	2NXX	0.8
NDR	(14beta,17alpha)-17-ethynyl-17- hydroxyestr-4-en-3-one	A,B	1SQN	0.73
NDR	(14beta,17alpha)-17-ethynyl-17- hydroxyestr-4-en-3-one	A,B	2W8Y	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	0.89
NOG	13-BETA-ETHYL-17-ALPHA-ETHYNYL- 17-BETA-HYDROXYGON-4-EN-3-ONE	A	1LHV	0.73
NOG	13-BETA-ETHYL-17-ALPHA-ETHYNYL- 17-BETA-HYDROXYGON-4-EN-3-ONE	A,B	3D90	0.73
CBW	(3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID	A	2W4Q	0.79
DOG	DIGOXIGENIN	A	1LKE	0.71
SNL	SPIRONOLACTONE	A,B	2AB2	0.73
SNL	SPIRONOLACTONE	A,B,C,D,E,F	2OAX	0.73
0MA	maslinic acid	A	2QN2	0.73
MVB	(1S,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO- 7-METHYL-8-[2-[(2R,4R)-TETRAHYDRO- 4-HY DROXY-6-OXO-2H-PYRAN-2-YL]ETHYL]- 1-NAPHTHALENOL	A,B,C	1YA8	0.7
S5H	5-ALPHA-PREGNANE-3-BETA-OL-HEMISUCCINATE	L	2DBL	0.73
AS4	ALDOSTERONE	A	2AA2	0.91
AS4	ALDOSTERONE	A	2Q1H	0.91
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.91
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.91
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	0.91
DL4	(14beta,17alpha,25R)-3-oxocholest- 4-en-26-oic acid	A	3GYT	0.8
GR4		H,I	1AWF	0.81
MOU		A,B	2NPF	0.76
2OB	CHOLESTERYL OLEATE	A	2OBD	0.77
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	0.76
FUA	FUSIDIC ACID	A	1QCA	0.76
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.76
FUA	FUSIDIC ACID	A,B	2VUF	0.76
20E	(2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one	A,D	2R40	0.8
PLO	(3BETA)-3-HYDROXYPREGN-5-EN-20- ONE	A	1Q20	0.78
TES	TESTOSTERONE	A	1JTV	0.81
TES	TESTOSTERONE	A	2Q7L	0.81
TES	TESTOSTERONE	A	2Q7I	0.81
TES	TESTOSTERONE	A,B	1J96	0.81
TES	TESTOSTERONE	A	2Q7K	0.81
TES	TESTOSTERONE	A,B	1Q13	0.81
TES	TESTOSTERONE	H	1I9J	0.81
TES	TESTOSTERONE	A,B	1AFS	0.81
TES	TESTOSTERONE	H	1VPO	0.81
TES	TESTOSTERONE	A	2Q7J	0.81
TES	TESTOSTERONE	A,B	3BUR	0.81
TES	TESTOSTERONE	A	2AM9	0.81
DTX	DIGITOXIGENIN	A	1LNM	0.72
CBO	CARBENOXOLONE	A,B,C,D	1HDC	0.82
CBO	CARBENOXOLONE	A,B,C,D	2BEL	0.82
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
SIM	SIMVASTATIN	A,B,C,D	1HW9	0.71
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	0.9
803	LOVASTATIN	A,B	1CQP	0.71
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.93
HCY	(11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione	A,B	2VDY	0.86
HCY	(11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione	A	2V95	0.86
ZK5	9ALPHA-FLUOROCORTISOL	A	1GS4	0.84
1CA	DESOXYCORTICOSTERONE	A,B	1Y9R	0.82
1CA	DESOXYCORTICOSTERONE	A,B,C	2ABI	0.82
1CA	DESOXYCORTICOSTERONE	A	2Q3Y	0.82
1CA	DESOXYCORTICOSTERONE	A	2AA7	0.82
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A,B	1E3R	0.77
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	3DHE	0.77
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	1J99	0.77
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	1COY	0.77
AND	3-BETA-HYDROXY-5-ANDROSTEN-17-ONE	A	1Q22	0.77
C0R	CORTICOSTERONE	A	2A3I	0.86
C0R	CORTICOSTERONE	A,B	1Y5R	0.86
DL7	(5beta,14beta,17alpha,25R)-3-oxocholest- 7-en-26-oic acid	A	3GYU	0.77
CLL	CHOLESTERYL LINOLEATE	A,B	1CLE	0.77