Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01988657
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 |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 2OK9 | 0.92 |  |
| PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 1Z76 | 0.92 | |
| PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A | 1BK9 | 0.92 | |
MQ8 | MENAQUINONE 8 | C,H,L,M | 1EYS | 0.74 | |
9TA | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.78 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.79 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1PRC | 0.74 | |
| MQ7 | MENAQUINONE-7 | A,B,D,M,N,P | 2B76 | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 5PRC | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 7PRC | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 2PRC | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 1R2C | 0.74 | |
| MQ7 | MENAQUINONE-7 | A,B,C,E,F,G | 2VPW | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 3PRC | 0.74 | |
| MQ7 | MENAQUINONE-7 | A,B,D,M,N,O,P | 1L0V | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 2JBL | 0.74 | |
| MQ7 | MENAQUINONE-7 | C,H,L,M | 6PRC | 0.74 | |
VK3 | MENADIONE | A | 1TUV | 0.76 | |
| VK3 | MENADIONE | A,B | 2QR2 | 0.76 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 3D38 | 0.74 | |
| MQ9 | MENAQUINONE-9 | C,H,L,M | 1VRN | 0.74 | |
| MQ9 | MENAQUINONE-9 | C,H,L,M | 2I5N | 0.74 | |
| MQ9 | MENAQUINONE-9 | C,H,L,M,U | 1DXR | 0.74 | |
825 | [{2-bromo-4-[(2R)-3-oxo-2,3-diphenylpropyl]phenyl}(difluoro)methyl]phosphonic acid | A | 3CWE | 0.77 | |
HPK | (3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE | A | 2PUH | 0.74 | |
DMW | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.76 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.81 | |
| AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.81 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.85 | |
| BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.85 | |
HBX | benzaldehyde | A,B | 3GDN | 0.73 | |
BP4 | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.72 | |
PQN | PHYLLOQUINONE | A,B,C,F,I,J, K,L,M,X | 1JB0 | 0.74 | |
| PQN | PHYLLOQUINONE | 1,2,3,4,A,B, C,F,G,H,I,J, K,L | 2O01 | 0.74 | |
| PQN | PHYLLOQUINONE | A,B,C,F,K,L | 2PPS | 0.74 | |
| PQN | PHYLLOQUINONE | A,B,C,F,K,L | 1C51 | 0.74 | |
| PQN | PHYLLOQUINONE | 0,1,2,3,4,5, 6,7,8,9,A,B, C,F,G,H,J,K, L,P,Q,R,U,V, W,Z | 1QZV | 0.74 | |
R01 | (4'-{[ALLYL(METHYL)AMINO]METHYL}- 1,1'-BIPHENYL-4-YL)(4-BROMOPHENYL)METHANONE | A,B,C | 1H35 | 0.76 | |
ANQ | ACENAPHTHENEQUINONE | H,J | 1OAX | 0.73 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.71 | |
| HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.71 | |
| HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.71 | |
| HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.71 | |
| HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.71 | |