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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02412492

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CA4CYPROTERONE ACETATEA2OZ70.7
HC220-HYDROXYCHOLESTEROLA1ZHW0.76
VD25-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-2-METHYL-
CYCLOHEXANE-1,3-DIOL
A1RKH0.72
LANLANOSTEROLA1W6K0.76
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A3EAU0.83
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A3EB30.83
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A3EB40.83
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A,B2AAX0.83
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A1H610.83
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A,B3CMF0.83
PDN17,21-DIHYDROXYPREGNA-1,4-DIENE-
3,11,20-TRIONE
A2Q1V0.83
DHT5-ALPHA-DIHYDROTESTOSTERONEL2PIP0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7M0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I380.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T740.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7R0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PKL0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T630.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDK0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1DHT0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIR0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T760.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2Z4J0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T790.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIO0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIV0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2QPY0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2AMA0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T650.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIX0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDM0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7T0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T5Z0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIQ0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIT0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIU0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIW0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I370.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1XJ70.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1D2S0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1F5F0.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T730.7
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7F0.7
HC325-HYDROXYCHOLESTEROLA1ZHX0.76
LVA(3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6-
DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}-
1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN-
1-YL)-3,5-DIHYDROXYHEPTANOIC ACID
A,B1T020.74
114COMPACTINA,B,C,D1HW80.74
ERGERGOSTEROLA1BXM0.8
ERGERGOSTEROLA1ZHZ0.8
ERGERGOSTEROLA,B2AIB0.8
PLO(3BETA)-3-HYDROXYPREGN-5-EN-20-
ONE
A1Q200.87
OXR4-OXORETINOLA,B1X8L0.7
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
A,D1R1K0.82
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,U1Z5X0.82
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,F,G,H2NXX0.82
C0RCORTICOSTERONEA2A3I0.9
C0RCORTICOSTERONEA,B1Y5R0.9
JC1(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-
1-[(2S,3S)-3-(2-hydroxyethyl)heptan-
2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-
1H-inden-4-ylidene]ethylidene]-
4-methylidene-cyclohexane-1,3-diol
A2ZXN0.71
STRPROGESTERONEA1H600.75
STRPROGESTERONEA,B,C1YA30.75
STRPROGESTERONEA,B2AA60.75
STRPROGESTERONEA1MRQ0.75
STRPROGESTERONEA,B1A280.75
STRPROGESTERONEA,B2AA50.75
STRPROGESTERONEA2HZQ0.75
STRPROGESTERONEA1W0F0.75
STRPROGESTERONEA2ABA0.75
STRPROGESTERONEA,B3COT0.75
STRPROGESTERONEH1DBB0.75
STRPROGESTERONEH,L2O5Y0.75
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione
A,B2VDY0.87
HCY(11alpha,14beta)-11,17,21-trihydroxypregn-
4-ene-3,20-dione
A2V950.87
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.88
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.88
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.88
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.88
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.88
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,C1YA80.77
SIHPROGESTERONE-11-ALPHA-OL-HEMISUCCINATEH1DBM0.82
AS4ALDOSTERONEA2AA20.86
AS4ALDOSTERONEA2Q1H0.86
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPG0.9
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPJ0.9
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE
A,B2IPF0.9
SIMSIMVASTATINA,B,C,D1HW90.77
VDY3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANOL
A,B1J780.74
VDY3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANOL
A,D1MZ90.74
17H17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-
PREGNA-4,9,11-TRIEN-3-ONE
A2AMB0.86
HEQ3-[18-(4-HYDROXY-2,6,6-TRIMETHYL-
CYCLOHEX-1-ENYL)-3,7,12,16-TETRAMETHYL-
OCTADECA-1,3,5,7,9,11,13,15, 17-
NONAENYL]-2,4,4-TRIMETHYL-CYCLOHEX-
2-ENONE
A,B1M980.77
0MAmaslinic acidA2QN20.74
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid
A3GYU0.79
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.75
ASD4-ANDROSTENE-3-17-DIONEA,B3CAS0.75
ASD4-ANDROSTENE-3-17-DIONEA1QYX0.75
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D2VCT0.75
ASD4-ANDROSTENE-3-17-DIONEA1EUP0.75
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.75
ASD4-ANDROSTENE-3-17-DIONEA3EQM0.75
ASD4-ANDROSTENE-3-17-DIONEA1XF00.75
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.82
1CADESOXYCORTICOSTERONEA,B1Y9R0.87
1CADESOXYCORTICOSTERONEA,B,C2ABI0.87
1CADESOXYCORTICOSTERONEA2Q3Y0.87
1CADESOXYCORTICOSTERONEA2AA70.87
AE2AETIOCHOLANOLONEA2QP40.7
AE2AETIOCHOLANOLONEA,B1YB10.7
AE2AETIOCHOLANOLONEA2QP30.7
AE2AETIOCHOLANOLONEA,B1X8J0.7
AE2AETIOCHOLANOLONEA,B,C,D1NFQ0.7
AE2AETIOCHOLANOLONEH1DBJ0.7
AE2AETIOCHOLANOLONEA1OV40.7
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.8
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.8
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.8
DL4(14beta,17alpha,25R)-3-oxocholest-
4-en-26-oic acid
A3GYT0.8
VD3(1S,3Z)-3-[(2E)-2-[(1R,3AR,7AS)-
7A-METHYL-1-[(2R)-6-METHYLHEPTAN-
2-YL]-2,3,3A,5,6,7-HEXAHYDRO-1H-
INDEN-4-YLIDENE]ETHYLIDENE]-4-METHYLIDENE-
CYCLOHEXAN-1-OL
A2GJ50.71
VD3(1S,3Z)-3-[(2E)-2-[(1R,3AR,7AS)-
7A-METHYL-1-[(2R)-6-METHYLHEPTAN-
2-YL]-2,3,3A,5,6,7-HEXAHYDRO-1H-
INDEN-4-YLIDENE]ETHYLIDENE]-4-METHYLIDENE-
CYCLOHEXAN-1-OL
A,B3C6G0.71
2OBCHOLESTERYL OLEATEA2OBD0.77
VDZ5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-2-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1RJK0.7
GR33-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,D1AWH0.79
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,B1BUQ0.8
FUAFUSIDIC ACIDA1QCA0.71
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.71
FUAFUSIDIC ACIDA,B2VUF0.71
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A1E3G0.86
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A,B1E3K0.86
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A2AO60.86
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A1XOW0.86
R18(17BETA)-17-HYDROXY-17-METHYLESTRA-
4,9,11-TRIEN-3-ONE
A1XQ30.86
MVD2ALPHA-METHYL-1ALPHA,25-DIHYDROXY-
VITAMIN D3
A2HB80.7
DEXDEXAMETHASONEA,D1M2Z0.85
DEXDEXAMETHASONEA,B,C,D1P930.85
D2V(3S,5Z,7E,22E)-9,10-secoergosta-
5,7,10,22-tetraen-3-ol
A,B3CZH0.73
CBW(3BETA,5BETA,14BETA)-3-HYDROXY-
11-OXOOLEAN-12-EN-29-OIC ACID
A2W4Q0.77
BDT5-beta-DIHYDROTESTOSTERONEA,B3DOP0.7
CBOCARBENOXOLONEA,B,C,D1HDC0.71
CBOCARBENOXOLONEA,B,C,D2BEL0.71
ZK59ALPHA-FLUOROCORTISOLA1GS40.85
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,B1P8D0.73
JB1(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-
1-[(2R,3S)-3-(2-hydroxyethyl)heptan-
2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-
1H-inden-4-ylidene]ethylidene]-
4-methylidene-cyclohexane-1,3-diol
A2ZXM0.71
0ASasiatic acidA2QN10.71
CLRCHOLESTEROLA,B2ZXE0.76
CLRCHOLESTEROLA1N830.76
CLRCHOLESTEROLA2RH10.76
CLRCHOLESTEROLA1LRI0.76
CLRCHOLESTEROLA1ZHY0.76
CLRCHOLESTEROLA3D4S0.76
C332ALPHA-PROPYL-1ALPHA,25-DIHYDROXYVITAMIN D3A2HAM0.7
803LOVASTATINA,B1CQP0.76
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A2ZBZ0.7
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1RK30.7
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1DB10.7
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1IE90.7
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A2HC40.7
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A2ZLC0.7
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A3CV90.7
AXTASTAXANTHINA,B1GKA0.75
NOG13-BETA-ETHYL-17-ALPHA-ETHYNYL-
17-BETA-HYDROXYGON-4-EN-3-ONE
A1LHV0.81
NOG13-BETA-ETHYL-17-ALPHA-ETHYNYL-
17-BETA-HYDROXYGON-4-EN-3-ONE
A,B3D900.81
HCR7-HYDROXYCHOLESTEROLA1ZHT0.75
NDR(14beta,17alpha)-17-ethynyl-17-
hydroxyestr-4-en-3-one
A,B1SQN0.81
NDR(14beta,17alpha)-17-ethynyl-17-
hydroxyestr-4-en-3-one
A,B2W8Y0.81
CLLCHOLESTERYL LINOLEATEA,B1CLE0.77
TESTESTOSTERONEA1JTV0.9
TESTESTOSTERONEA2Q7L0.9
TESTESTOSTERONEA2Q7I0.9
TESTESTOSTERONEA,B1J960.9
TESTESTOSTERONEA2Q7K0.9
TESTESTOSTERONEA,B1Q130.9
TESTESTOSTERONEH1I9J0.9
TESTESTOSTERONEA,B1AFS0.9
TESTESTOSTERONEH1VPO0.9
TESTESTOSTERONEA2Q7J0.9
TESTESTOSTERONEA,B3BUR0.9
TESTESTOSTERONEA2AM90.9