Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01265179
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 |
TRJ | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.7 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.7 | |
MN7 | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | N | 1NLO | 0.74 | |
IOY | P-IODO-D-PHENYLALANINE | A | 1XBU | 0.72 | |
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 | |
APF | 1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE) | B,C | 1GG6 | 0.71 | |
APF | 1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE) | G | 6GCH | 0.71 | |
MX3 | (1-{4-[BENZYL(METHYL)AMINO]-4-OXOBUTANOYL}HYDRAZINO)ACETIC ACID | I | 2C2O | 0.72 | |
EOA | N-PHENETHYL-FORMAMIDE | H,I | 1A5G | 0.72 | |
APE | (1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID | E,I | 1SCN | 0.76 | |
FRF | PHE-REDUCED-PHE | A,I | 1GVX | 0.72 | |
MEA | N-METHYLPHENYLALANINE | A | 2PIL | 0.76 | |
MEA | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.76 | |
MEA | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.76 | |
MY3 | [N-(3-BENZYLCARBAMOYL-OXIRANECARBONYL)- HYDRAZINO] - ACETIC ACID | A,I | 2CNL | 0.73 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.72 | |
PSS | ETHYLAMINOBENZYLMETHYLCARBONYL GROUP | A | 1EAG | 0.7 | |
MBH | 1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION | A | 1BMA | 0.7 | |
SP8 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNS | 0.7 | |
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.72 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 1YYL | 0.7 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 2I5Y | 0.7 | |
ING | D-[(AMINO)CARBONYL]PHENYLALANINE | A,B | 1UF8 | 0.72 | |
ING | D-[(AMINO)CARBONYL]PHENYLALANINE | A,B,D,E | 1HDU | 0.72 | |
2BF | ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID | A,B,C,D | 1ND5 | 0.74 | |
HPE | HOMOPHENYLALANINE | A,B | 1B1H | 0.72 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B,C,D | 1SN9 | 0.79 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B | 1SNE | 0.79 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B,C,D | 1SNA | 0.79 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B | 1XOF | 0.79 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A | 1QWC | 0.7 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1FOI | 0.7 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1QW5 | 0.7 | |
HDB | (R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL)BENZYL)GUANIDINE | A | 1ZMJ | 0.7 | |
SK3 | (1R,2R,3S,4S,5R)-5-(BENZYLAMINO)CYCLOPENTANE- 1,2,3,4-TETROL | A | 2F7R | 0.71 | |
HMF | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.72 | |
TIO | (2-MERCAPTOMETHYL-3-PHENYL-PROPIONYL)- GLYCINE | E | 1ZDP | 0.71 | |
4BA | 4-[(2-CARBOXY-ETHYLAMINO)-METHYL]- BENZOIC ACID | C | 1FAV | 0.77 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.74 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.74 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.74 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.74 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.74 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.74 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.74 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.74 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.74 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.74 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.74 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.74 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.74 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.74 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.74 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.74 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.74 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.74 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.74 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.74 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.74 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.74 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.74 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.74 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.74 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.74 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.74 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.74 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.74 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.74 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.74 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.74 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.74 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.74 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.74 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.74 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.74 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.74 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.74 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.74 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.74 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.74 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.74 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.74 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.74 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.74 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.74 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.74 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.74 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.74 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.74 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.74 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.74 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.74 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.74 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.74 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.74 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.74 | |
FBA | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.75 | |
FBA | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.75 | |
F1J | (2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine- 2-carboxamide | A | 2ZJJ | 0.72 | |
R1F | 3-{[(2,2,5,5-TETRAMETHYL-1-OXO- 4-PHENYL-2,5-DIHYDRO-1H-PYRROLIUM- 3-YL)METHYL]DISULFANYL}-D-ALANINE | A | 1ZUR | 0.71 | |
BCS | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.71 | |
BCS | BENZYLCYSTEINE | A | 1EH8 | 0.71 | |
ABN | BENZYLAMINE | D,H | 2HXC | 0.71 | |
ABN | BENZYLAMINE | A,I | 1A86 | 0.71 | |
ABN | BENZYLAMINE | A | 1UTN | 0.71 | |
ABN | BENZYLAMINE | A | 1N6X | 0.71 | |
ABN | BENZYLAMINE | A | 2BZA | 0.71 | |
ABN | BENZYLAMINE | A | 2EUS | 0.71 | |
ABN | BENZYLAMINE | A | 1N6Y | 0.71 | |
ABN | BENZYLAMINE | A | 1UTJ | 0.71 | |
RAS | N-PROPARGYL-1(R)-AMINONDAN | A,B | 2BK4 | 0.71 | |
RAS | N-PROPARGYL-1(R)-AMINONDAN | A,B | 1S2Q | 0.71 | |
F1K | (2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine- 2-carboxamide | A,B,C | 2ZJK | 0.72 | |
1PA | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.7 | |
MN2 | 1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE | N | 1NLO | 0.94 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.73 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.74 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.74 | |
4FP | 4-(4-FLUOROBENZYL)PIPERIDINE | A | 2OHN | 0.72 | |
TFQ | 4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE | A | 3D6V | 0.73 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY5 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY8 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY9 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XXZ | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY4 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY6 | 0.79 | |
MPQ | N-METHYL-ALPHA-PHENYL-GLYCINE | D | 1D6E | 0.76 | |
RRT | (R)-RETRO-THIORPHAN | E | 1Z9G | 0.79 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 3F3C | 0.77 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,E,F | 2UUE | 0.77 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 1ZNT | 0.77 | |
PFF | 4-FLUORO-L-PHENYLALANINE | F,H | 1OL1 | 0.77 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,F,H | 2C5V | 0.77 | |
PFF | 4-FLUORO-L-PHENYLALANINE | E,F | 1OL2 | 0.77 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C73 | 0.71 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 1S2Y | 0.71 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C75 | 0.71 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C76 | 0.71 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C72 | 0.71 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.72 | |
S2D | N-BENZOYL-D-ALANINE | A,B | 2JCI | 0.77 | |
RM1 | N-METHYL-1(R)-AMINOINDAN | A,B | 2C67 | 0.71 | |
BAC | N-(4-IODO-BENZYL)-FORMAMIDE | A,B,C,D | 2WPO | 0.74 | |
BR4 | 6-PHENYL-4(R)-(7-PHENYL-HEPTANOYLAMINO)- HEXANOIC ACID | A | 1KQU | 0.7 | |
FPA | 1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE | E,I | 4EST | 0.77 | |
CXA | PHENYLALANINE-N-SULFONAMIDE | A | 1IY7 | 0.71 | |
NPG | N-SUCCINYL PHENYLGLYCINE | A,B,C,D | 1SJD | 0.73 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.77 | |
BNF | N-BENZYLFORMAMIDE | A,B | 1U3U | 0.76 | |
SP9 | N-{(1R)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNT | 0.7 | |
37U | D-phenylalanyl-N-(3-fluorobenzyl)- L-prolinamide | H,I | 2ZDV | 0.7 | |
NDF | N-(CARBOXYCARBONYL)-D-PHENYLALANINE | A | 1YCI | 0.73 | |
PHI | IODO-PHENYLALANINE | A | 1TF9 | 0.72 | |
PHI | IODO-PHENYLALANINE | A,B,C,D | 1ORW | 0.72 | |
PHI | IODO-PHENYLALANINE | A | 1T6H | 0.72 | |
PHI | IODO-PHENYLALANINE | A,B,C | 1NLU | 0.72 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA1 | 0.72 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA4 | 0.72 | |
PHI | IODO-PHENYLALANINE | P | 1CZI | 0.72 | |
LO1 | [[4-(AMINOMETHYL)PHENYL]AMINO]OXO- ACETIC ACID, | A | 1WAX | 0.72 | |
ZAE | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.76 | |
J54 | (2R)-3-{[(BENZYLAMINO)CARBONYL]AMINO}- 2-HYDROXYPROPANOIC ACID | A | 2V35 | 0.78 | |
IDI | 7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE | A,B | 1N7J | 0.71 |