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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01788851

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1CADESOXYCORTICOSTERONEA,B1Y9R0.86
1CADESOXYCORTICOSTERONEA,B,C2ABI0.86
1CADESOXYCORTICOSTERONEA2Q3Y0.86
1CADESOXYCORTICOSTERONEA2AA70.86
114COMPACTINA,B,C,D1HW80.75
BIV21-NOR-9,10-SECOCHOLESTA-5,7,10(19)-
TRIENE-1,3,25-TRIOL, 20-(4-HYDROXY-
4-METHYLPENTYL)-, (1A,3B,5Z,7E)
A2HCD0.73
ANBANDROSTA-1,4-DIENE-3,17-DIONEA1H620.71
0MAmaslinic acidA2QN20.85
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA,B1E3R0.94
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA3DHE0.94
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1J990.94
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1COY0.94
AND3-BETA-HYDROXY-5-ANDROSTEN-17-ONEA1Q220.94
803LOVASTATINA,B1CQP0.77
ATE16,17-ANDROSTENE-3-OLA,B1XNX0.72
2OBCHOLESTERYL OLEATEA2OBD0.9
AS4ALDOSTERONEA2AA20.8
AS4ALDOSTERONEA2Q1H0.8
C0RCORTICOSTERONEA2A3I0.84
C0RCORTICOSTERONEA,B1Y5R0.84
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID
A2ZB40.7
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID
A,B1V3V0.7
ASD4-ANDROSTENE-3-17-DIONEA,B3CAS0.73
ASD4-ANDROSTENE-3-17-DIONEA1QYX0.73
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D2VCT0.73
ASD4-ANDROSTENE-3-17-DIONEA1EUP0.73
ASD4-ANDROSTENE-3-17-DIONEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.73
ASD4-ANDROSTENE-3-17-DIONEA3EQM0.73
ASD4-ANDROSTENE-3-17-DIONEA1XF00.73
0ASasiatic acidA2QN10.83
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID
A,B2G5W0.7
C332ALPHA-PROPYL-1ALPHA,25-DIHYDROXYVITAMIN D3A2HAM0.74
AE2AETIOCHOLANOLONEA2QP40.73
AE2AETIOCHOLANOLONEA,B1YB10.73
AE2AETIOCHOLANOLONEA2QP30.73
AE2AETIOCHOLANOLONEA,B1X8J0.73
AE2AETIOCHOLANOLONEA,B,C,D1NFQ0.73
AE2AETIOCHOLANOLONEH1DBJ0.73
AE2AETIOCHOLANOLONEA1OV40.73
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.79
17H17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-
PREGNA-4,9,11-TRIEN-3-ONE
A2AMB0.76
BDT5-beta-DIHYDROTESTOSTERONEA,B3DOP0.73