Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015587
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 |
W29 | 4-(3-ethylthiophen-2-yl)benzene- 1,2-diol | A | 3D27 | 0.72 |  |
SDT | 3,4-dihydroxy-9,10-secoandrosta- 1(10),2,4-triene-9,17-dione | A,B | 2ZI8 | 0.73 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.71 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.7 | |
| DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.7 | |
| DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.7 | |
| DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.7 | |
PIT | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.72 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.73 | |
| DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.73 | |
| DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.73 | |
| DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.73 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.71 | |
| MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.71 | |
| MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.71 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.7 | |
| AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.7 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.75 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.75 | |
| BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.75 | |
| BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.75 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.75 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.75 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.75 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.7 | |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.77 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.75 | |
| DHC | CAFFEIC ACID | A | 1KOU | 0.75 | |
789 | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.7 | |
OBP | A,B | 2DE3 | 0.8 | | |
LZ2 | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.73 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.71 | |
AZN | ALIZARIN RED | H,I,J,K,L,M, N,O | 1OAR | 0.81 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.71 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.71 | |
D1N | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.72 | |
EQI | EQUILIN | A,B | 1EQU | 0.71 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.75 | |