MMsINC Database Search
logo   logo
logo Search | Help | MolPaint | Roadmap | Credits | Feedback


Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02513885

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CHDCHOLIC ACIDA,B2PNJ0.74
CHDCHOLIC ACIDA,B1HRK0.74
CHDCHOLIC ACIDA,B2PO70.74
CHDCHOLIC ACIDA2QO60.74
CHDCHOLIC ACIDA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z		1V550.74
CHDCHOLIC ACIDA2AZY0.74
CHDCHOLIC ACIDA,B,C2DQY0.74
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z		2EIN0.74
CHDCHOLIC ACIDA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z		2EIJ0.74
CHDCHOLIC ACIDA,B,C,D2QD10.74
CHDCHOLIC ACIDA2FT90.74
CHDCHOLIC ACIDA,B2HRC0.74
CHDCHOLIC ACIDA,B1TW40.74
CHDCHOLIC ACIDA,B2QD30.74
CHDCHOLIC ACIDA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z		1V540.74
CHDCHOLIC ACIDA2RLC0.74
CHDCHOLIC ACIDA,B1ON50.74
CHDCHOLIC ACIDA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z		2ZXW0.74
CHDCHOLIC ACIDA,B2QD40.74
CHDCHOLIC ACIDA2QO50.74
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2DYS0.74
CHDCHOLIC ACIDA,B2QD20.74
CHDCHOLIC ACIDA,B,C3ELZ0.74
CHDCHOLIC ACIDA,B2PO50.74
CHDCHOLIC ACIDA,B1S9Q0.74
CHDCHOLIC ACIDA,B1EE20.74
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2DYR0.74
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2EIM0.74
CHDCHOLIC ACIDA,B,C,D2HRE0.74
CHDCHOLIC ACIDA,B2QD50.74
CHDCHOLIC ACIDA,B3EM00.74
CHDCHOLIC ACIDA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2EIL0.74
CHDCHOLIC ACIDA2QO40.74
CHDCHOLIC ACIDA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z		2EIK0.74
MVD2ALPHA-METHYL-1ALPHA,25-DIHYDROXY-
VITAMIN D3		A2HB80.79
IU5ISO-URSODEOXYCHOLIC ACIDA,B1IHI0.74
IU5ISO-URSODEOXYCHOLIC ACIDA,B1OT70.74
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		A2ZXN0.8
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		A2GJ50.77
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,B3C6G0.77
JN3CHENODEOXYCHOLIC ACIDA2JN30.74
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA1S0X0.74
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA2Q9F0.74
C3SCHOLEST-5-EN-3-YL HYDROGEN SULFATEA,B,C2HKA0.74
VD15-{2-[1-(1-METHYL-PROPYL)-7A-METHYL-
OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-
2-METHYLENE-CYCLOHEXANE-1,3-DIOL		A1RKG0.78
AON5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA-
DIOL		A1LHN0.83
VDZ5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-2-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A1RJK0.79
XE41,3-CYCLOHEXANEDIOL, 4-METHYLENE-
5-[(2E)-[(1S,3AS,7AS)-OCTAHYDRO-
1-(5-HYDROXY-5-METHYL-1,3-HEXADIYNYL)-
7A-METHYL-4H-INDEN-4-YLIDENE]ETHYLIDENE]-
, (1R,3S,5Z)		A2HBH0.74
KH15-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)-
ETHYL]-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE}-ETHYLIDENE)-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A1IE80.78
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A2ZBZ0.79
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A1RK30.79
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A1DB10.79
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A1IE90.79
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A2HC40.79
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A2ZLC0.79
VDX5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL		A3CV90.79
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A,B,C,D1WB10.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A,B,C,D1WB30.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A2BJF0.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A,B,C,D1WB20.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A1FM40.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A2W1B0.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A,B1E3V0.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A1OS60.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A,B,C,D3DTU0.71
DXC(3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN-
24-OIC ACID		A2OPX0.71
LANLANOSTEROLA1W6K0.8
OCC2ALPHA-(3-HYDROXYPROPOXY)-1ALPHA,25-
DIHYDROXYVITAMIN D3		A2HAR0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEL2PIP0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7M0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I380.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T740.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7R0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PKL0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T630.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDK0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1DHT0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIR0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T760.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2Z4J0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T790.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIO0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIV0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2QPY0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2AMA0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T650.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIX0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDM0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7T0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T5Z0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIQ0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIT0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIU0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIW0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I370.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1XJ70.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1D2S0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1F5F0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T730.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7F0.73
TX5(1R,3R)-5-((Z)-2-((1R,7AS)-HEXAHYDRO-
1-((S)-6-HYDROXY-6-METHYLHEPT-4-
YN-2-YL)-7A-METHYL-1H-INDEN-4(7AH)-
YLIDENE)ETHYLIDENE)CYCLOHEXANE-
1,3-DIOL		A1TXI0.74
VD4(1R,3R,7E,17Z)-17-(5-hydroxy-1,5-
dimethylhexylidene)-2-methylene-
9,10-secoestra-5,7-diene-1,3-diol		A2O4J0.77
ERGERGOSTEROLA1BXM0.79
ERGERGOSTEROLA1ZHZ0.79
ERGERGOSTEROLA,B2AIB0.79
CHC6-ETHYL-CHENODEOXYCHOLIC ACIDA,B1OT70.74
CHC6-ETHYL-CHENODEOXYCHOLIC ACIDA,B1OSV0.74
TESTESTOSTERONEA1JTV0.74
TESTESTOSTERONEA2Q7L0.74
TESTESTOSTERONEA2Q7I0.74
TESTESTOSTERONEA,B1J960.74
TESTESTOSTERONEA2Q7K0.74
TESTESTOSTERONEA,B1Q130.74
TESTESTOSTERONEH1I9J0.74
TESTESTOSTERONEA,B1AFS0.74
TESTESTOSTERONEH1VPO0.74
TESTESTOSTERONEA2Q7J0.74
TESTESTOSTERONEA,B3BUR0.74
TESTESTOSTERONEA2AM90.74
BIV21-NOR-9,10-SECOCHOLESTA-5,7,10(19)-
TRIENE-1,3,25-TRIOL, 20-(4-HYDROXY-
4-METHYLPENTYL)-, (1A,3B,5Z,7E)		A2HCD0.77
COV(1S,3R,5Z,7E,14beta,17alpha)-17-
[(2S,4S)-4-(2-hydroxy-2-methylpropyl)-
2-methyltetrahydrofuran-2-yl]-9,10-
secoandrosta-5,7,10-triene-1,3-
diol		A3CS40.75
HC325-HYDROXYCHOLESTEROLA1ZHX0.82
TT2(1R,3R,7E,17beta)-17-{(1S,2E,5R)-
5-hydroxy-1-methyl-5-[(3S,5S,7S)-
tricyclo[3.3.1.1~3,7~]dec-1-yl]pent-
2-en-1-yl}-2-methylidene-9,10-secoestra-
5,7-diene-1,3-diol		A2ZMI0.72
C332ALPHA-PROPYL-1ALPHA,25-DIHYDROXYVITAMIN D3A2HAM0.79
FUAFUSIDIC ACIDA1QCA0.73
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1Q230.73
FUAFUSIDIC ACIDA,B2VUF0.73
HCR7-HYDROXYCHOLESTEROLA1ZHT0.8
D2V(3S,5Z,7E,22E)-9,10-secoergosta-
5,7,10,22-tetraen-3-ol		A,B3CZH0.76
HC220-HYDROXYCHOLESTEROLA1ZHW0.82
C3O2ALPHA-PROPOXY-1ALPHA,25-DIHYDROXYVITAMIN D3A2HAS0.73
MI4(1R,3R,7E,17beta)-17-{(1S,2E,5R)-
5-hydroxy-1-methyl-6-[(3S,5S,7S)-
tricyclo[3.3.1.1~3,7~]dec-1-yl]hex-
2-en-1-yl}-2-methylidene-9,10-secoestra-
5,7-diene-1,3-diol		A2ZMJ0.73
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,B1P8D0.78
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		A2ZXM0.8
1CADESOXYCORTICOSTERONEA,B1Y9R0.71
1CADESOXYCORTICOSTERONEA,B,C2ABI0.71
1CADESOXYCORTICOSTERONEA2Q3Y0.71
1CADESOXYCORTICOSTERONEA2AA70.71
MC9CALCIPOTRIOLA1S190.74
NYA(1R,3R,7E,17beta)-17-{(1R,2E,4R)-
4-hydroxy-1-methyl-4-[(3S,5S,7S)-
tricyclo[3.3.1.1~3,7~]dec-1-yl]but-
2-en-1-yl}-2-methylidene-9,10-secoestra-
5,7-diene-1,3-diol		A2ZMH0.71
V2H(1S,3R,5Z,7E,22E)-9,10-secoergosta-
5,7,10,22-tetraene-1,3-diol		A,B3DL90.77
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.74
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.74
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.74
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.74
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.74
VD25-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-2-METHYL-
CYCLOHEXANE-1,3-DIOL		A1RKH0.81
CLRCHOLESTEROLA,B2ZXE0.82
CLRCHOLESTEROLA1N830.82
CLRCHOLESTEROLA2RH10.82
CLRCHOLESTEROLA1LRI0.82
CLRCHOLESTEROLA1ZHY0.82
CLRCHOLESTEROLA3D4S0.82
O1C2ALPHA-(3-HYDROXYPROPYL)-1ALPHA,25-
DIHYDROXYVITAMIN D3		A2HB70.78
0CO(1S,3R,5Z,7E,14beta,17alpha,23R)-
23-(2-hydroxy-2-methylpropyl)-20,24-
epoxy-9,10-secochola-5,7,10-triene-
1,3-diol		A3CS60.75
VDY3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANOL		A,B1J780.8
VDY3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-
HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-
CYCLOHEXANOL		A,D1MZ90.8
AE2AETIOCHOLANOLONEA2QP40.73
AE2AETIOCHOLANOLONEA,B1YB10.73
AE2AETIOCHOLANOLONEA2QP30.73
AE2AETIOCHOLANOLONEA,B1X8J0.73
AE2AETIOCHOLANOLONEA,B,C,D1NFQ0.73
AE2AETIOCHOLANOLONEH1DBJ0.73
AE2AETIOCHOLANOLONEA1OV40.73
EB1SEOCALCITOLA1S0Z0.75
AOM5-ALPHA-ANDROSTANE-3-BETA,17BETA-
DIOL		A1LHO0.83
C0RCORTICOSTERONEA2A3I0.7
C0RCORTICOSTERONEA,B1Y5R0.7
ATE16,17-ANDROSTENE-3-OLA,B1XNX0.79
DOGDIGOXIGENINA1LKE0.73
BDT5-beta-DIHYDROTESTOSTERONEA,B3DOP0.73
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE		A,B2IPG0.74
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE		A,B2IPJ0.74
FFA(10ALPHA,13ALPHA,14BETA,17ALPHA)-
17-HYDROXYANDROST-4-EN-3-ONE		A,B2IPF0.74
VD5(1R,3R,7E,17E)-17-(5-hydroxy-1,5-
dimethylhexylidene)-2-methylene-
9,10-secoestra-5,7-diene-1,3-diol		A2O4R0.77
DTXDIGITOXIGENINA1LNM0.74
PLO(3BETA)-3-HYDROXYPREGN-5-EN-20-
ONE		A1Q200.75