Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02257089
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 |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 1YYL | 0.72 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 2I5Y | 0.72 | |
MEA | N-METHYLPHENYLALANINE | A | 2PIL | 0.71 | |
MEA | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.71 | |
MEA | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.71 | |
GSB | S-BENZYL-GLUTATHIONE | A,B,C,D | 1FRO | 0.76 | |
GSB | S-BENZYL-GLUTATHIONE | A,B,C,D | 1GUH | 0.76 | |
PM3 | 2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID | A,L,M | 3FEA | 0.71 | |
PM3 | 2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID | P | 1CWD | 0.71 | |
PM3 | 2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID | L | 3FE7 | 0.71 | |
PM3 | 2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID | B | 2GV2 | 0.71 | |
PM3 | 2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID | B,D | 1CWE | 0.71 | |
1PA | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.73 | |
PNM | OPEN FORM - PENICILLIN G | A | 1GHP | 0.72 | |
PNM | OPEN FORM - PENICILLIN G | A | 1PWC | 0.72 | |
PNM | OPEN FORM - PENICILLIN G | A | 1IYQ | 0.72 | |
PNM | OPEN FORM - PENICILLIN G | A | 1FQG | 0.72 | |
PNM | OPEN FORM - PENICILLIN G | A,B,C,D | 2J8Y | 0.72 | |
PNM | OPEN FORM - PENICILLIN G | A,B,C,D | 2JBF | 0.72 | |
PNM | OPEN FORM - PENICILLIN G | A | 2EX8 | 0.72 | |
IGL | ALPHA-AMINO-2-INDANACETIC ACID | A | 1BDK | 0.71 | |
TI1 | [2(R,S)-2-SULFANYLHEPTANOYL]-PHE- ALA | A | 1R1I | 0.75 | |
TI1 | [2(R,S)-2-SULFANYLHEPTANOYL]-PHE- ALA | A | 1QF1 | 0.75 | |
FBD | N-({(1R)-1-carboxy-2-[(4-fluorobenzyl)sulfanyl]ethyl}carbamoyl)- L-glutamic acid | A | 3D7D | 0.75 | |
IOY | P-IODO-D-PHENYLALANINE | A | 1XBU | 0.74 | |
0A9 | methyl L-phenylalaninate | A | 1AY2 | 0.7 | |
0A9 | methyl L-phenylalaninate | I | 5ER1 | 0.7 | |
0A9 | methyl L-phenylalaninate | I,P | 1HDT | 0.7 | |
PBB | S-(4-BROMOBENZYL)CYSTEINE | A,B,C,D | 1AQV | 0.84 | |
BCS | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.94 | |
BCS | BENZYLCYSTEINE | A | 1EH8 | 0.94 | |
CXA | PHENYLALANINE-N-SULFONAMIDE | A | 1IY7 | 0.77 | |
R1F | 3-{[(2,2,5,5-TETRAMETHYL-1-OXO- 4-PHENYL-2,5-DIHYDRO-1H-PYRROLIUM- 3-YL)METHYL]DISULFANYL}-D-ALANINE | A | 1ZUR | 0.79 | |
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.74 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.75 | |
OIR | N-(3-PHENYL-2-SULFANYLPROPANOYL)PHENYLALANYLALANINE | A | 1R1J | 0.73 | |
RRT | (R)-RETRO-THIORPHAN | E | 1Z9G | 0.74 | |
GGC | 1-MENAPHTHYL GLUTATHIONE CONJUGATE | A,B | 3LJR | 0.7 | |
BDL | N-(biphenyl-4-ylsulfonyl)-D-leucine | A | 3EHX | 0.72 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.71 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.71 | |
CS4 | S-[3-(3,4-DICHLOROPHENYL)-3-OXOPROPYL]- L-CYSTEINE | A | 2OQZ | 0.73 | |
2BL | (3R)-3-ethyl-N-[(4-methylphenyl)sulfonyl]- L-aspartic acid | A | 1BTU | 0.72 | |
GBI | S-(3-IODOBENZYL)GLUTATHIONE | A | 2GSQ | 0.74 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1O0D | 0.76 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FES | 0.76 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2ANK | 0.76 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FEQ | 0.76 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2A2X | 0.76 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1NZQ | 0.76 | |
PHI | IODO-PHENYLALANINE | A | 1TF9 | 0.74 | |
PHI | IODO-PHENYLALANINE | A,B,C,D | 1ORW | 0.74 | |
PHI | IODO-PHENYLALANINE | A | 1T6H | 0.74 | |
PHI | IODO-PHENYLALANINE | A,B,C | 1NLU | 0.74 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA1 | 0.74 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA4 | 0.74 | |
PHI | IODO-PHENYLALANINE | P | 1CZI | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.76 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.76 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.76 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.76 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.76 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.76 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.76 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.76 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.76 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.76 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.76 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.76 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.76 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.76 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.76 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.76 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.76 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.76 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.76 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.76 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.76 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.76 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.76 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.76 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.76 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.76 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.76 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.76 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.76 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.76 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.76 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.76 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.76 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.76 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.76 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.76 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.76 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.76 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.76 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.76 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.76 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.76 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.76 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.76 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.76 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.76 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.76 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.76 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.76 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.76 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.76 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.76 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.76 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.76 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.76 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.76 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.76 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.76 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.76 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.76 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.76 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.76 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.76 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.76 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.76 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.76 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.76 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.76 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.76 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.76 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.76 | |
IBG | GAMMA-GLUTAMYL[S-(2-IODOBENZYL)CYSTEINYL]GLYCINE | A | 1M9B | 0.74 | |
TST | 4-METHYL-2-{[4-(TOLUENE-4-SULFONYL)- THIOMORPHOLINE-3-CARBONYL]-AMINO}- PENTANOIC ACID | A | 1J4I | 0.72 | |
MN2 | 1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE | N | 1NLO | 0.7 | |
SEB | O-BENZYLSULFONYL-SERINE | A,B,C,D | 2APJ | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1IAV | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A,B | 1IEC | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1ZIY | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1C9N | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1ZJ4 | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1GGV | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1Q5P | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1PQA | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1ZJ5 | 0.82 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1C9M | 0.82 | |
G23 | (2R,4S)-2-[(R)-BENZYLCARBAMOYL- PHENYLACETYL-METHYL]-5,5-DIMETHYL- THIAZOLIDINE-4-CARBOXYLIC ACID | A | 1HTE | 0.7 | |
PNN | PENICILLIN G | A,B | 1GM7 | 0.71 | |
PNN | PENICILLIN G | B | 1FXV | 0.71 | |
PNN | PENICILLIN G | A | 1UOF | 0.71 | |
PNN | PENICILLIN G | A | 1UOB | 0.71 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 3F3C | 0.74 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,E,F | 2UUE | 0.74 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 1ZNT | 0.74 | |
PFF | 4-FLUORO-L-PHENYLALANINE | F,H | 1OL1 | 0.74 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,F,H | 2C5V | 0.74 | |
PFF | 4-FLUORO-L-PHENYLALANINE | E,F | 1OL2 | 0.74 | |
TFQ | 4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE | A | 3D6V | 0.72 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.74 | |
TIO | (2-MERCAPTOMETHYL-3-PHENYL-PROPIONYL)- GLYCINE | E | 1ZDP | 0.72 | |
HMF | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.76 | |
ZAE | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.71 | |
HPE | HOMOPHENYLALANINE | A,B | 1B1H | 0.76 |