Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02110528
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 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.71 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.71 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.71 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.71 | ![]() |
TA2![]() | (2R,3S)-3-AMINO-3-PHENYLPROPANE- 1,2-DIOL | A,B | 2IFR | 0.8 | ![]() |
COR![]() | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.74 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCS | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1GOE | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RM9 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1SOC | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1ABJ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1DWE | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I,M | 1HLT | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,H,L | 1J9C | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I,T | 1TMB | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2JRY | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2SOC | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2YYF | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HGT | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,D | 2Q3I | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,P | 1MCD | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1HAO | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1Z8J | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,C | 2PGQ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1NRR | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1PPB | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HPP | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C | 2OD3 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1B0Q | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1Z8I | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I,J | 1TMU | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1GO9 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCF | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RME | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 1TMT | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1ABI | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | R | 1NRQ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B | 2Q33 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L | 1DAN | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCE | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RMI | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1W7M | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1HAP | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B | 1ORF | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1IHS | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCC | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RMD | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2JQB | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HPQ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | C,E,F | 1SHH | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,I | 1CVR | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | L,P | 1AUT | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCI | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 3F6U | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1BFW | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 1HAI | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C | 2THF | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1IHT | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A,P | 1MCJ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1TKH | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2FMZ | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1YL9 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1HUT | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1FXY | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1YL8 | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L | 1QFK | 0.7 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCB | 0.7 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.7 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.7 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.7 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.7 | ![]() |
PHK![]() | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1MU0 | 0.74 | ![]() |
PHK![]() | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1XRL | 0.74 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.71 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.71 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.71 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.71 | ![]() |
TTL![]() | TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN5 | 0.7 | ![]() |
HPH![]() | PHENYLALANINDIOL | I | 1E5O | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 1ODX | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 1MTB | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 2FGV | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A | 1ODW | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 2FGU | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 1HXB | 0.78 | ![]() |
GB1![]() | (2R,3R,4S)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F18 | 0.7 | ![]() |
GB2![]() | (2R,3R,4S)-2-({[(1S)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F1A | 0.7 | ![]() |
PDH![]() | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.82 | ![]() |
GB3![]() | (2R,3R,4S,5R)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)-5-METHYLPYRROLIDINE- 3,4-DIOL | A | 2F1B | 0.71 | ![]() |
CTL![]() | CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN3 | 0.7 | ![]() |
PHL![]() | L-PHENYLALANINOL | A,B | 1JOH | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | I | 3APR | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1DLZ | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1IH9 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1OB4 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | I | 2ER6 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1R9U | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1OB7 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A,B | 1OB6 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A,B,C | 1AMT | 0.82 | ![]() |
C3M![]() | N-[(2R,3S)-3-AMINO-2-HYDROXY-4- PHENYLBUTYL]NAPHTHALENE-2-SULFONAMIDE | B,I | 2C8Y | 0.7 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1ZSR | 0.81 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZJ7 | 0.81 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZLF | 0.81 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEG | 0.81 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1FQX | 0.81 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1IIQ | 0.81 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEF | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZSF | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A | 1JLD | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDA | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDB | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1Z8C | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZBG | 0.81 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZPK | 0.81 | ![]() |
PO0![]() | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.7 | ![]() |
PO0![]() | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.7 | ![]() |
BCS![]() | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.7 | ![]() |
BCS![]() | BENZYLCYSTEINE | A | 1EH8 | 0.7 | ![]() |