Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02110529
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 |
V36 | L-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID | B,C | 1VGC | 0.71 | |
TTL | TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN5 | 0.72 | |
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.7 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.72 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.72 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.72 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.72 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.72 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.72 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.72 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.72 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.72 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.72 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.72 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.72 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.72 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.72 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.72 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.72 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.72 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.72 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.72 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.72 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.72 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.72 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.72 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.72 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.72 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.72 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.72 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.72 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.72 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.72 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.72 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.72 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.72 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.72 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.72 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.72 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.72 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.72 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.72 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.72 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.72 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.72 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.72 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.72 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.72 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.72 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.72 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.72 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.72 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.72 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.72 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.72 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.72 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.72 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.72 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.72 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.72 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.72 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.72 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.72 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.72 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.72 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.72 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.72 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.72 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.72 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1MU0 | 0.85 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1XRL | 0.85 | |
TA2 | (2R,3S)-3-AMINO-3-PHENYLPROPANE- 1,2-DIOL | A,B | 2IFR | 0.82 | |
GVQ | (2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE | A | 2UW8 | 0.73 | |
2CM | 2-CHLORO-6-METHYL-ANILINE | A | 1OVH | 0.7 | |
IOY | P-IODO-D-PHENYLALANINE | A | 1XBU | 0.7 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.72 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.72 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.71 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.71 | |
CTL | CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN3 | 0.72 | |
C2A | 1-(3-CHLOROPHENYL)METHANAMINE | B,I | 2C8Z | 0.8 | |
GB2 | (2R,3R,4S)-2-({[(1S)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F1A | 0.72 | |
GB3 | (2R,3R,4S,5R)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)-5-METHYLPYRROLIDINE- 3,4-DIOL | A | 2F1B | 0.71 | |
HMF | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.7 | |
HPE | HOMOPHENYLALANINE | A,B | 1B1H | 0.7 | |
GB1 | (2R,3R,4S)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F18 | 0.72 | |
CLD | D-PARA-CHLOROPHENYL-1-ACTEAMIDOBORONIC ACID ALANINE | A | 1AVT | 0.7 | |
CLB | D-PARA-CHLOROPHENYL-1-ACETAMIDOBORONIC ACID ALANINE | A | 1VSB | 0.7 | |
FCL | 3-CHLORO-L-PHENYLALANINE | E,F | 1OKW | 0.81 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 3F3C | 0.7 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,E,F | 2UUE | 0.7 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 1ZNT | 0.7 | |
PFF | 4-FLUORO-L-PHENYLALANINE | F,H | 1OL1 | 0.7 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,F,H | 2C5V | 0.7 | |
PFF | 4-FLUORO-L-PHENYLALANINE | E,F | 1OL2 | 0.7 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.7 | |
HPH | PHENYLALANINDIOL | I | 1E5O | 0.81 | |
HPH | PHENYLALANINDIOL | A,B | 1ODX | 0.81 | |
HPH | PHENYLALANINDIOL | A,B | 1MTB | 0.81 | |
HPH | PHENYLALANINDIOL | A,B | 2FGV | 0.81 | |
HPH | PHENYLALANINDIOL | A | 1ODW | 0.81 | |
HPH | PHENYLALANINDIOL | A,B | 2FGU | 0.81 | |
HPH | PHENYLALANINDIOL | A,B | 1HXB | 0.81 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.71 | |
V35 | D-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID | B,C | 2VGC | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.71 | |
LY1 | 8,9-DICHLORO-2,3,4,5-TETRAHYDRO- 1H-BENZO[C]AZEPINE | A,B | 1N7I | 0.7 | |
PSA | 3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | I | 1EPL | 0.7 | |
PSA | 3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | A,B,C,D | 2IFW | 0.7 | |
PSA | 3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | E,I | 1EPM | 0.7 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZSF | 0.82 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A | 1JLD | 0.82 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDA | 0.82 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDB | 0.82 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1Z8C | 0.82 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZBG | 0.82 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZPK | 0.82 | |
PHI | IODO-PHENYLALANINE | A | 1TF9 | 0.7 | |
PHI | IODO-PHENYLALANINE | A,B,C,D | 1ORW | 0.7 | |
PHI | IODO-PHENYLALANINE | A | 1T6H | 0.7 | |
PHI | IODO-PHENYLALANINE | A,B,C | 1NLU | 0.7 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA1 | 0.7 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA4 | 0.7 | |
PHI | IODO-PHENYLALANINE | P | 1CZI | 0.7 | |
COR | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.76 | |
C2B | 1-(4-CHLOROPHENYL)METHANAMINE | D,H | 2Q7Q | 0.78 | |
PDH | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.84 | |
200 | 4-CHLORO-L-PHENYLALANINE | A,B | 2AKW | 0.8 | |
PHL | L-PHENYLALANINOL | A,B | 1JOH | 0.84 | |
PHL | L-PHENYLALANINOL | I | 3APR | 0.84 | |
PHL | L-PHENYLALANINOL | A | 1DLZ | 0.84 | |
PHL | L-PHENYLALANINOL | A | 1IH9 | 0.84 | |
PHL | L-PHENYLALANINOL | A | 1OB4 | 0.84 | |
PHL | L-PHENYLALANINOL | I | 2ER6 | 0.84 | |
PHL | L-PHENYLALANINOL | A | 1R9U | 0.84 | |
PHL | L-PHENYLALANINOL | A | 1OB7 | 0.84 | |
PHL | L-PHENYLALANINOL | A,B | 1OB6 | 0.84 | |
PHL | L-PHENYLALANINOL | A,B,C | 1AMT | 0.84 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1ZSR | 0.82 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZJ7 | 0.82 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZLF | 0.82 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEG | 0.82 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1FQX | 0.82 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1IIQ | 0.82 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEF | 0.82 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.7 |