Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01291116
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 |
CPU![]() | A,B | 1CR6 | 0.75 | ![]() | |
PBN![]() | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.76 | ![]() |
PBN![]() | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.76 | ![]() |
PRA![]() | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.76 | ![]() |
PRA![]() | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.76 | ![]() |
NFP![]() | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.72 | ![]() |
NFP![]() | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.72 | ![]() |
L13![]() | 4-AMINO-5-(2-METHYLPHENYL)-2,4- DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE | A | 2HB9 | 0.73 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.72 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.72 | ![]() |
14W![]() | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A | 1QWC | 0.7 | ![]() |
14W![]() | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1FOI | 0.7 | ![]() |
14W![]() | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1QW5 | 0.7 | ![]() |
ABN![]() | BENZYLAMINE | D,H | 2HXC | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A,I | 1A86 | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A | 1UTN | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A | 1N6X | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A | 2BZA | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A | 2EUS | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A | 1N6Y | 0.71 | ![]() |
ABN![]() | BENZYLAMINE | A | 1UTJ | 0.71 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A | 1UTO | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.77 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A | 1UTM | 0.77 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.75 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.75 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.75 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.75 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.75 | ![]() |
FPA![]() | 1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE | E,I | 4EST | 0.71 | ![]() |
TPA![]() | TRANS-2-PHENYLCYCLOPROPYLAMINE | A | 1TNL | 0.71 | ![]() |
BZZ![]() | BENZYLHYDRAZINE | A,B | 2E2V | 0.77 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.75 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.75 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.75 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.75 | ![]() |
BAS![]() | N-(1-PHENYL-PROPYL)-FORMAMIDE | E,F,G,H | 1NJU | 0.7 | ![]() |
BAS![]() | N-(1-PHENYL-PROPYL)-FORMAMIDE | Y,Z | 1JQ7 | 0.7 | ![]() |
BAS![]() | N-(1-PHENYL-PROPYL)-FORMAMIDE | C | 1NKM | 0.7 | ![]() |
4FP![]() | 4-(4-FLUOROBENZYL)PIPERIDINE | A | 2OHN | 0.72 | ![]() |
PO0![]() | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.75 | ![]() |
PO0![]() | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.75 | ![]() |
007![]() | 1-METHYLAMINE-1-BENZYL-CYCLOPENTANE | A,B,C,D | 2BUA | 0.7 | ![]() |
271![]() | N-methyl-1-phenylmethanamine | X | 2RBT | 0.75 | ![]() |
EOA![]() | N-PHENETHYL-FORMAMIDE | H,I | 1A5G | 0.76 | ![]() |
RM1![]() | N-METHYL-1(R)-AMINOINDAN | A,B | 2C67 | 0.71 | ![]() |
DPK![]() | DEPRENYL | A,B | 2BYB | 0.7 | ![]() |
BNF![]() | N-BENZYLFORMAMIDE | A,B | 1U3U | 0.71 | ![]() |
APE![]() | (1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID | E,I | 1SCN | 0.74 | ![]() |