Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02861539
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 |
2SK![]() | (1R,2R,3R,4S,5R)-4-(BENZYLAMINO)- 5-(METHYLTHIO)CYCLOPENTANE-1,2,3- TRIOL | A | 2F7P | 0.74 | ![]() |
GB2![]() | (2R,3R,4S)-2-({[(1S)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F1A | 0.85 | ![]() |
APL![]() | N-(1-BENZYL-3,3,3-TRIFLUORO-2,2- DIHYDROXY-PROPYL)-ACETAMIDE | B,C | 1GG6 | 0.75 | ![]() |
BAS![]() | N-(1-PHENYL-PROPYL)-FORMAMIDE | E,F,G,H | 1NJU | 0.74 | ![]() |
BAS![]() | N-(1-PHENYL-PROPYL)-FORMAMIDE | Y,Z | 1JQ7 | 0.74 | ![]() |
BAS![]() | N-(1-PHENYL-PROPYL)-FORMAMIDE | C | 1NKM | 0.74 | ![]() |
CTL![]() | CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN3 | 0.74 | ![]() |
FRF![]() | PHE-REDUCED-PHE | A,I | 1GVX | 0.72 | ![]() |
GB1![]() | (2R,3R,4S)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F18 | 0.85 | ![]() |
GB7![]() | (3R,4R,5R)-3,4-dihydroxy-5-({[(1R)- 2-hydroxy-1-phenylethyl]amino}methyl)- 1-methylpyrrolidin-2-one | A | 3DDG | 0.74 | ![]() |
DPK![]() | DEPRENYL | A,B | 2BYB | 0.71 | ![]() |
COR![]() | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.77 | ![]() |
1PA![]() | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.7 | ![]() |
BAV![]() | (3S,14R,16S)-16-[(1R)-1-hydroxy- 2-{[3-(1-methylethyl)benzyl]amino}ethyl]- 3,4,14-trimethyl-1,4-diazacyclohexadecane- 2,5-dione | A,B,C | 3DV5 | 0.74 | ![]() |
GB3![]() | (2R,3R,4S,5R)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)-5-METHYLPYRROLIDINE- 3,4-DIOL | A | 2F1B | 0.84 | ![]() |
BTM![]() | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.71 | ![]() |
GB6![]() | (3R,4R,5R)-3,4-dihydroxy-5-({[(1R)- 2-hydroxy-1-phenylethyl]amino}methyl)pyrrolidin- 2-one | A | 3DDF | 0.74 | ![]() |
AHT![]() | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCS | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1GOE | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RM9 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1SOC | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1ABJ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1DWE | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I,M | 1HLT | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,H,L | 1J9C | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I,T | 1TMB | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2JRY | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2SOC | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2YYF | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HGT | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,D | 2Q3I | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,P | 1MCD | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1HAO | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1Z8J | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,C | 2PGQ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1NRR | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1PPB | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HPP | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C | 2OD3 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1B0Q | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1Z8I | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I,J | 1TMU | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1GO9 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCF | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RME | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 1TMT | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1ABI | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | R | 1NRQ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B | 2Q33 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L | 1DAN | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCE | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RMI | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1W7M | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1HAP | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B | 1ORF | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1IHS | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCC | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RMD | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2JQB | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HPQ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | C,E,F | 1SHH | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,I | 1CVR | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | L,P | 1AUT | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCI | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 3F6U | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1BFW | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 1HAI | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C | 2THF | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1IHT | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A,P | 1MCJ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1TKH | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2FMZ | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1YL9 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1HUT | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1FXY | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1YL8 | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L | 1QFK | 0.71 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCB | 0.71 | ![]() |
216![]() | [4-R-(4-ALPHA,6-BETA,7-BETA]-HEXAHYDRO- 5,6-DI(HYDROXY)-1,3-DI(ALLYL)-4,7- BISPHENYLMETHYL)-2H-1,3-DIAZEPINONE | B | 1HWR | 0.74 | ![]() |
271![]() | N-methyl-1-phenylmethanamine | X | 2RBT | 0.72 | ![]() |
BNF![]() | N-BENZYLFORMAMIDE | A,B | 1U3U | 0.71 | ![]() |