Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03063058
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 |
CLB | D-PARA-CHLOROPHENYL-1-ACETAMIDOBORONIC ACID ALANINE | A | 1VSB | 0.71 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.71 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.71 | |
C2A | 1-(3-CHLOROPHENYL)METHANAMINE | B,I | 2C8Z | 0.76 | |
4FP | 4-(4-FLUOROBENZYL)PIPERIDINE | A | 2OHN | 0.79 | |
CRP | ((1RS,3SR)-2,2-DICHLORO-N-[(R)- 1-(4-CHLOROPHENYL)ETHYL]-1-ETHYL- 3-METHYLCYCLOPROPANECARBOXAMIDE | A | 2STD | 0.74 | |
CRP | ((1RS,3SR)-2,2-DICHLORO-N-[(R)- 1-(4-CHLOROPHENYL)ETHYL]-1-ETHYL- 3-METHYLCYCLOPROPANECARBOXAMIDE | A,B,C | 7STD | 0.74 | |
IDI | 7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE | A,B | 1N7J | 0.72 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.74 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.74 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.74 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.74 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.72 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.75 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.75 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.71 | |
LY1 | 8,9-DICHLORO-2,3,4,5-TETRAHYDRO- 1H-BENZO[C]AZEPINE | A,B | 1N7I | 0.8 | |
DPK | DEPRENYL | A,B | 2BYB | 0.73 | |
GVQ | (2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE | A | 2UW8 | 0.82 | |
EOA | N-PHENETHYL-FORMAMIDE | H,I | 1A5G | 0.71 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.74 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.74 | |
CPU | A,B | 1CR6 | 0.71 | ||
1PC | 1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE | B,C | 2PCP | 0.71 | |
C2B | 1-(4-CHLOROPHENYL)METHANAMINE | D,H | 2Q7Q | 0.77 | |
CLD | D-PARA-CHLOROPHENYL-1-ACTEAMIDOBORONIC ACID ALANINE | A | 1AVT | 0.71 |