Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02851800
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 |
4PI | N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE | A,B | 2NSD | 0.71 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.72 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.72 | |
IDI | 7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE | A,B | 1N7J | 0.73 | |
1PC | 1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE | B,C | 2PCP | 0.86 | |
BS1 | (3-EXO)-3-(10,11-DIHYDRO-5H-DIBENZO[A,D][7]ANNULEN- 5-YLOXY)-8,8-DIMETHYL-8-AZONIABICYCLO[3.2.1]OCTANE | A,F | 2W8F | 0.71 | |
4FP | 4-(4-FLUOROBENZYL)PIPERIDINE | A | 2OHN | 0.8 | |
B2Y | 1-biphenyl-2-ylmethanamine | A,B,C,D | 3CCB | 0.77 | |
DPK | DEPRENYL | A,B | 2BYB | 0.79 | |
GVQ | (2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE | A | 2UW8 | 0.7 | |
SB7 | [HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL | A | 2AI7 | 0.71 | |
SB7 | [HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL | A,B,C | 2AI8 | 0.71 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.76 | |
1PB | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.73 | |
007 | 1-METHYLAMINE-1-BENZYL-CYCLOPENTANE | A,B,C,D | 2BUA | 0.72 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.72 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.72 | |
L18 | (2S)-1-methyl-2-[(2S,4R)-2-methyl- 4-phenylpentyl]piperidine | A | 2JJG | 0.89 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.72 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.72 | |
RMA | N-[(1S)-2,3-DIHYDRO-1H-INDEN-1- YL]-N-METHYL-N-PROP-2-YNYLAMINE | A,B | 1S3B | 0.71 | |
TPA | TRANS-2-PHENYLCYCLOPROPYLAMINE | A | 1TNL | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.71 | |
DP4 | TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE- N-OXIDE | A,B,C,D,E,F, G,H | 1ND0 | 0.73 |