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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03130377

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHT5-ALPHA-DIHYDROTESTOSTERONEL2PIP0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7M0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I380.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T740.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7R0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PKL0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T630.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDK0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1DHT0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIR0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T760.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2Z4J0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T790.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIO0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIV0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2QPY0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2AMA0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T650.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIX0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDM0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7T0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T5Z0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIQ0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIT0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIU0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIW0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I370.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1XJ70.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1D2S0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1F5F0.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T730.86
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7F0.86
CO117-[3-(3,3-DIMETHYL-OXIRANYL)-1-
METHYL-PROPYL]-10,13-DIMETHYL-2,3,4,7,8,9,10,11,12,13,14,15,16,17-
TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-
3-OL
A,B1P8D0.71
AOM5-ALPHA-ANDROSTANE-3-BETA,17BETA-
DIOL
A1LHO1
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D1WB10.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D1WB30.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A2BJF0.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D1WB20.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A1FM40.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A2W1B0.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B1E3V0.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A1OS60.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D3DTU0.83
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A2OPX0.83
VDY3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANOL
A,B1J780.72
VDY3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANOL
A,D1MZ90.72
ATE16,17-ANDROSTENE-3-OLA,B1XNX0.74
CLRCHOLESTEROLA,B2ZXE0.74
CLRCHOLESTEROLA1N830.74
CLRCHOLESTEROLA2RH10.74
CLRCHOLESTEROLA1LRI0.74
CLRCHOLESTEROLA1ZHY0.74
CLRCHOLESTEROLA3D4S0.74
S5H5-ALPHA-PREGNANE-3-BETA-OL-HEMISUCCINATEL2DBL0.75
ERGERGOSTEROLA1BXM0.71
ERGERGOSTEROLA1ZHZ0.71
ERGERGOSTEROLA,B2AIB0.71
AE2AETIOCHOLANOLONEA2QP40.86
AE2AETIOCHOLANOLONEA,B1YB10.86
AE2AETIOCHOLANOLONEA2QP30.86
AE2AETIOCHOLANOLONEA,B1X8J0.86
AE2AETIOCHOLANOLONEA,B,C,D1NFQ0.86
AE2AETIOCHOLANOLONEH1DBJ0.86
AE2AETIOCHOLANOLONEA1OV40.86
LANLANOSTEROLA1W6K0.72
CHC6-ETHYL-CHENODEOXYCHOLIC ACIDA,B1OT70.81
CHC6-ETHYL-CHENODEOXYCHOLIC ACIDA,B1OSV0.81
BDT5-beta-DIHYDROTESTOSTERONEA,B3DOP0.86
HC220-HYDROXYCHOLESTEROLA1ZHW0.75
JN3CHENODEOXYCHOLIC ACIDA2JN30.81
HC325-HYDROXYCHOLESTEROLA1ZHX0.75
CHDCHOLIC ACIDA,B2PNJ0.81
CHDCHOLIC ACIDA,B1HRK0.81
CHDCHOLIC ACIDA,B2PO70.81
CHDCHOLIC ACIDA2QO60.81
CHDCHOLIC ACIDA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.81
CHDCHOLIC ACIDA2AZY0.81
CHDCHOLIC ACIDA,B,C2DQY0.81
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.81
CHDCHOLIC ACIDA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.81
CHDCHOLIC ACIDA,B,C,D2QD10.81
CHDCHOLIC ACIDA2FT90.81
CHDCHOLIC ACIDA,B2HRC0.81
CHDCHOLIC ACIDA,B1TW40.81
CHDCHOLIC ACIDA,B2QD30.81
CHDCHOLIC ACIDA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.81
CHDCHOLIC ACIDA2RLC0.81
CHDCHOLIC ACIDA,B1ON50.81
CHDCHOLIC ACIDA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z
2ZXW0.81
CHDCHOLIC ACIDA,B2QD40.81
CHDCHOLIC ACIDA2QO50.81
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.81
CHDCHOLIC ACIDA,B2QD20.81
CHDCHOLIC ACIDA,B,C3ELZ0.81
CHDCHOLIC ACIDA,B2PO50.81
CHDCHOLIC ACIDA,B1S9Q0.81
CHDCHOLIC ACIDA,B1EE20.81
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.81
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.81
CHDCHOLIC ACIDA,B,C,D2HRE0.81
CHDCHOLIC ACIDA,B2QD50.81
CHDCHOLIC ACIDA,B3EM00.81
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.81
CHDCHOLIC ACIDA2QO40.81
CHDCHOLIC ACIDA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.81
IU5ISO-URSODEOXYCHOLIC ACIDA,B1IHI0.81
IU5ISO-URSODEOXYCHOLIC ACIDA,B1OT70.81
HCR7-HYDROXYCHOLESTEROLA1ZHT0.73
AON5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA-
DIOL
A1LHN1