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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00556527

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SO1A1U2R0.7
SO1A1N0U0.7
SO1T2P8Y0.7
SO1T2P8Z0.7
JN3CHENODEOXYCHOLIC ACIDA2JN30.85
BDT5-beta-DIHYDROTESTOSTERONEA,B3DOP0.79
CHDCHOLIC ACIDA,B2PNJ0.85
CHDCHOLIC ACIDA,B1HRK0.85
CHDCHOLIC ACIDA,B2PO70.85
CHDCHOLIC ACIDA2QO60.85
CHDCHOLIC ACIDA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.85
CHDCHOLIC ACIDA2AZY0.85
CHDCHOLIC ACIDA,B,C2DQY0.85
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.85
CHDCHOLIC ACIDA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.85
CHDCHOLIC ACIDA,B,C,D2QD10.85
CHDCHOLIC ACIDA2FT90.85
CHDCHOLIC ACIDA,B2HRC0.85
CHDCHOLIC ACIDA,B1TW40.85
CHDCHOLIC ACIDA,B2QD30.85
CHDCHOLIC ACIDA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.85
CHDCHOLIC ACIDA2RLC0.85
CHDCHOLIC ACIDA,B1ON50.85
CHDCHOLIC ACIDA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z
2ZXW0.85
CHDCHOLIC ACIDA,B2QD40.85
CHDCHOLIC ACIDA2QO50.85
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.85
CHDCHOLIC ACIDA,B2QD20.85
CHDCHOLIC ACIDA,B,C3ELZ0.85
CHDCHOLIC ACIDA,B2PO50.85
CHDCHOLIC ACIDA,B1S9Q0.85
CHDCHOLIC ACIDA,B1EE20.85
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.85
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.85
CHDCHOLIC ACIDA,B,C,D2HRE0.85
CHDCHOLIC ACIDA,B2QD50.85
CHDCHOLIC ACIDA,B3EM00.85
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.85
CHDCHOLIC ACIDA2QO40.85
CHDCHOLIC ACIDA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.85
FUAFUSIDIC ACIDA1QCA0.7
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.7
FUAFUSIDIC ACIDA,B2VUF0.7
AE2AETIOCHOLANOLONEA2QP40.79
AE2AETIOCHOLANOLONEA,B1YB10.79
AE2AETIOCHOLANOLONEA2QP30.79
AE2AETIOCHOLANOLONEA,B1X8J0.79
AE2AETIOCHOLANOLONEA,B,C,D1NFQ0.79
AE2AETIOCHOLANOLONEH1DBJ0.79
AE2AETIOCHOLANOLONEA1OV40.79
IU5ISO-URSODEOXYCHOLIC ACIDA,B1IHI0.85
IU5ISO-URSODEOXYCHOLIC ACIDA,B1OT70.85
NTHSUCCINIC 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,B1BUQ0.75
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D1WB10.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D1WB30.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A2BJF0.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D1WB20.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A1FM40.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A2W1B0.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B1E3V0.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A1OS60.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A,B,C,D3DTU0.87
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID
A2OPX0.87
CHC6-ETHYL-CHENODEOXYCHOLIC ACIDA,B1OT70.85
CHC6-ETHYL-CHENODEOXYCHOLIC ACIDA,B1OSV0.85
AON5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA-
DIOL
A1LHN0.79
S5H5-ALPHA-PREGNANE-3-BETA-OL-HEMISUCCINATEL2DBL0.94
AOM5-ALPHA-ANDROSTANE-3-BETA,17BETA-
DIOL
A1LHO0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEL2PIP0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7M0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I380.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T740.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7R0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PKL0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T630.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDK0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1DHT0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIR0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T760.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2Z4J0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T790.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIO0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIV0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2QPY0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2AMA0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T650.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIX0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDM0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7T0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T5Z0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIQ0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIT0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIU0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIW0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I370.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1XJ70.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1D2S0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1F5F0.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T730.79
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7F0.79
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.76
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.76
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.76
SIHPROGESTERONE-11-ALPHA-OL-HEMISUCCINATEH1DBM0.74