Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02430575
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
|---|---|---|---|---|---|
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.75 |  |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.72 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.74 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.74 | |
EZT | (17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA- 1(10),2,4-TRIENE-3,17-DIOL | A,B | 2P15 | 0.74 | |
DRQ | (9ALPHA,13BETA,17BETA)-2-[(1Z)- BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE- 3,17-DIOL | A,B | 2G5O | 0.74 | |
ANF | ANTHRONE | H | 2BJM | 0.72 | |
OBP | A,B | 2DE3 | 0.7 | | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.76 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.76 | |
ECS | 2,3,17BETA-TRIHYDROXY-1,3,5(10)- ESTRATRIENE | A,B,C,D | 2BW7 | 0.71 | |
DIN | 1,6-DIHYDROXY NAPHTHALENE | A | 1ZB6 | 0.73 | |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.75 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.76 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.72 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.73 | |
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.7 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.71 | |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.72 | |
EQI | EQUILIN | A,B | 1EQU | 0.72 | |
OX4 | 3-FLUORO-4-HYDROXYBENZALDEHYDE O- (CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOW | 0.75 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.75 | |
D1N | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.71 | |
EED | (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)- 11-(METHOXYMETHYL)ESTRA-1(10),2,4- TRIENE-3,17-DIOL | A,B | 2QGT | 0.72 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.74 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.74 | |
| BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.74 | |
| BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.74 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.74 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.74 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.74 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2I | 0.74 | |
| ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2J | 0.74 | |
EST | ESTRADIOL | A,B | 1GWR | 0.75 | |
| EST | ESTRADIOL | A | 1FDS | 0.75 | |
| EST | ESTRADIOL | A,B,C | 1G50 | 0.75 | |
| EST | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.75 | |
| EST | ESTRADIOL | A,B | 1A52 | 0.75 | |
| EST | ESTRADIOL | A | 1FDT | 0.75 | |
| EST | ESTRADIOL | A | 2OCF | 0.75 | |
| EST | ESTRADIOL | A,B,C | 1QKU | 0.75 | |
| EST | ESTRADIOL | A,B,C,D,L | 1E6W | 0.75 | |
| EST | ESTRADIOL | A | 1IOL | 0.75 | |
| EST | ESTRADIOL | H | 1JNN | 0.75 | |
| EST | ESTRADIOL | B | 1QKT | 0.75 | |
| EST | ESTRADIOL | A | 1FDW | 0.75 | |
| EST | ESTRADIOL | A,B | 1AQU | 0.75 | |
| EST | ESTRADIOL | A | 1LHU | 0.75 | |
| EST | ESTRADIOL | A | 1A27 | 0.75 | |
| EST | ESTRADIOL | L | 1JGL | 0.75 | |
| EST | ESTRADIOL | A,B,E,F | 1PCG | 0.75 | |
| EST | ESTRADIOL | A,B,C,D | 1FDU | 0.75 | |
| EST | ESTRADIOL | A | 2J7X | 0.75 | |
| EST | ESTRADIOL | A,B | 2D06 | 0.75 | |
178 | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.75 | |
| 2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.75 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.78 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.76 | |
| DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.76 | |
| DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.76 | |
| DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.76 | |
RM2 | 4-HYDROXY-N-PROPARGYL-1(R)-AMINOINDAN | A,B | 2C66 | 0.78 | |
ESL | ESTRIOL | A | 1X8V | 0.73 | |
E3O | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.73 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.75 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.77 | |
555 | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.8 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.72 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.77 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.75 | |
SDT | 3,4-dihydroxy-9,10-secoandrosta- 1(10),2,4-triene-9,17-dione | A,B | 2ZI8 | 0.71 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1J3F | 0.71 | |
| CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1UFJ | 0.71 | |
| CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1V9Q | 0.71 | |
EYK | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.71 | |
| EYK | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.71 | |
17M | 17-METHYL-17-ALPHA-DIHYDROEQUILENIN | A,B | 2B1Z | 0.75 | |
MA0 | (1R)-6-HYDROXY-N-METHYL-N-[(1Z)- PROP-2-EN-1-YLIDENE]INDAN-1-AMINIUM | A,B | 2C64 | 0.76 | |
ECO | ESTRADIOL-6 CARBOXYL-METHYL-OXIME | B,D,F,H | 1JNH | 0.73 | |
EQU | EQUILENIN | A,B | 1OGX | 0.71 | |
| EQU | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.71 | |
| EQU | EQUILENIN | A,B | 1OH0 | 0.71 | |
| EQU | EQUILENIN | A | 1W6Y | 0.71 | |
| EQU | EQUILENIN | A,B | 1CQS | 0.71 | |
| EQU | EQUILENIN | A | 1OGZ | 0.71 | |
| EQU | EQUILENIN | A | 1GS3 | 0.71 | |
| EQU | EQUILENIN | A | 1OHO | 0.71 | |
166 | 6-CARBAMIMIDOYL-2-[2-HYDROXY-6- (4-HYDROXY-PHENYL)-INDAN-1-YL]- HEXANOIC ACID | B,I | 1QJ1 | 0.71 | |
TN1 | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.76 | |
55E | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.77 | |