MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02420260

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
JN3	CHENODEOXYCHOLIC ACID	A	2JN3	0.89
S5H	5-ALPHA-PREGNANE-3-BETA-OL-HEMISUCCINATE	L	2DBL	0.91
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.73
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.73
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	0.73
DHT	5-ALPHA-DIHYDROTESTOSTERONE	L	2PIP	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T7M	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1I38	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T74	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T7R	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PKL	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T63	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1KDK	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1DHT	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIR	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T76	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2Z4J	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T79	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIO	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIV	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2QPY	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2AMA	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T65	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIX	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1KDM	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T7T	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T5Z	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIQ	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIT	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIU	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	2PIW	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1I37	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1XJ7	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1D2S	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1F5F	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T73	0.86
DHT	5-ALPHA-DIHYDROTESTOSTERONE	A	1T7F	0.86
IU5	ISO-URSODEOXYCHOLIC ACID	A,B	1IHI	0.89
IU5	ISO-URSODEOXYCHOLIC ACID	A,B	1OT7	0.89
CHD	CHOLIC ACID	A,B	2PNJ	0.89
CHD	CHOLIC ACID	A,B	1HRK	0.89
CHD	CHOLIC ACID	A,B	2PO7	0.89
CHD	CHOLIC ACID	A	2QO6	0.89
CHD	CHOLIC ACID	A,B,C,E,F,G, I,J,M,N,O,P, Q,S,T,V,W,Z	1V55	0.89
CHD	CHOLIC ACID	A	2AZY	0.89
CHD	CHOLIC ACID	A,B,C	2DQY	0.89
CHD	CHOLIC ACID	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Y,Z	2EIN	0.89
CHD	CHOLIC ACID	A,B,C,F,G,I, J,L,M,N,O,P, S,T,V,W,Z	2EIJ	0.89
CHD	CHOLIC ACID	A,B,C,D	2QD1	0.89
CHD	CHOLIC ACID	A	2FT9	0.89
CHD	CHOLIC ACID	A,B	2HRC	0.89
CHD	CHOLIC ACID	A,B	1TW4	0.89
CHD	CHOLIC ACID	A,B	2QD3	0.89
CHD	CHOLIC ACID	A,B,C,D,E,F, G,I,J,L,M,N, O,P,Q,S,T,V, W,Z	1V54	0.89
CHD	CHOLIC ACID	A	2RLC	0.89
CHD	CHOLIC ACID	A,B	1ON5	0.89
CHD	CHOLIC ACID	A,B,C,D,F,G, J,L,M,N,O,P, S,T,W,Z	2ZXW	0.89
CHD	CHOLIC ACID	A,B	2QD4	0.89
CHD	CHOLIC ACID	A	2QO5	0.89
CHD	CHOLIC ACID	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2DYS	0.89
CHD	CHOLIC ACID	A,B	2QD2	0.89
CHD	CHOLIC ACID	A,B,C	3ELZ	0.89
CHD	CHOLIC ACID	A,B	2PO5	0.89
CHD	CHOLIC ACID	A,B	1S9Q	0.89
CHD	CHOLIC ACID	A,B	1EE2	0.89
CHD	CHOLIC ACID	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2DYR	0.89
CHD	CHOLIC ACID	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2EIM	0.89
CHD	CHOLIC ACID	A,B,C,D	2HRE	0.89
CHD	CHOLIC ACID	A,B	2QD5	0.89
CHD	CHOLIC ACID	A,B	3EM0	0.89
CHD	CHOLIC ACID	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2EIL	0.89
CHD	CHOLIC ACID	A	2QO4	0.89
CHD	CHOLIC ACID	A,B,C,E,F,G, I,J,L,M,N,O, P,Q,S,T,V,W, Y,Z	2EIK	0.89
SO1		A	1U2R	0.72
SO1		A	1N0U	0.72
SO1		T	2P8Y	0.72
SO1		T	2P8Z	0.72
TWN	(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN- 2-YL]BUTYL LAURATE	A,B	2IVD	0.72
TWN	(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN- 2-YL]BUTYL LAURATE	A,B	2IVE	0.72
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	0.72
AON	5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA- DIOL	A	1LHN	0.79
CHC	6-ETHYL-CHENODEOXYCHOLIC ACID	A,B	1OT7	0.89
CHC	6-ETHYL-CHENODEOXYCHOLIC ACID	A,B	1OSV	0.89
AE2	AETIOCHOLANOLONE	A	2QP4	0.86
AE2	AETIOCHOLANOLONE	A,B	1YB1	0.86
AE2	AETIOCHOLANOLONE	A	2QP3	0.86
AE2	AETIOCHOLANOLONE	A,B	1X8J	0.86
AE2	AETIOCHOLANOLONE	A,B,C,D	1NFQ	0.86
AE2	AETIOCHOLANOLONE	H	1DBJ	0.86
AE2	AETIOCHOLANOLONE	A	1OV4	0.86
CAH	5-EXO-HYDROXYCAMPHOR	A	1NOO	0.73
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.72
AOM	5-ALPHA-ANDROSTANE-3-BETA,17BETA- DIOL	A	1LHO	0.79
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A,B,C,D	1WB1	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A,B,C,D	1WB3	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A	2BJF	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A,B,C,D	1WB2	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A	1FM4	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A	2W1B	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A,B	1E3V	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A	1OS6	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A,B,C,D	3DTU	0.92
DXC	(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID	A	2OPX	0.92
2OB	CHOLESTERYL OLEATE	A	2OBD	0.7
BDT	5-beta-DIHYDROTESTOSTERONE	A,B	3DOP	0.86
CLL	CHOLESTERYL LINOLEATE	A,B	1CLE	0.7