Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02247096
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 |
1LP | TRANYLCYPROMINE | A,B | 1OJB | 0.76 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.7 | |
I4B | ISOBUTYLBENZENE | A | 184L | 0.7 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 2OK9 | 0.89 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 1Z76 | 0.89 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A | 1BK9 | 0.89 | |
DMW | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.73 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.7 | |
OXE | ORTHO-XYLENE | A | 188L | 0.7 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.78 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.78 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.78 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.78 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.78 | |
HPQ | HOMOPHENYLALANINYLMETHANE | B | 1EWP | 0.72 | |
FPR | PROPYLBENZENE | C | 1RHK | 0.72 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.7 | |
CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.7 | |
CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.7 | |
HPK | (3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE | A | 2PUH | 0.71 | |
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.71 | |
VK3 | MENADIONE | A | 1TUV | 0.73 | |
VK3 | MENADIONE | A,B | 2QR2 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.71 | |
3PL | 3-PHENYLPROPANAL | E | 1Y3G | 0.78 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 2Q5O | 0.71 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 1LCO | 0.71 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B,C,D,E,F | 2ZF4 | 0.71 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 1BW9 | 0.71 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.75 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.75 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.77 | |
BP4 | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.72 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.71 | |
HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.71 | |
HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.71 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.71 | |
HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.71 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.71 | |
HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.71 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.8 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.8 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.72 | |
PYL | PHENYLETHANE | C | 1B07 | 0.72 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.72 | |
PYL | PHENYLETHANE | A | 1NHB | 0.72 | |
KPV | 5-PHENYL-2-KETO-VALERIC ACID | A,B | 2Q5Q | 0.71 | |
PHM | PHENYLALANYLMETHANE | A,I | 1PJP | 0.72 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2J9J | 0.72 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2JE4 | 0.72 |