Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02841895
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 |
TNC![]() | 4-DIMETHYLAMINO-1,10,11,12-TETRAHYDROXY- 3-OXO-3,4,4A,5-TETRAHYDRO-NAPHTHACENE- 2-CARBOXYLIC ACID AMIDE | A,B | 1N5Q | 0.73 | ![]() |
DGH![]() | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.72 | ![]() |
DGH![]() | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | A,B,C,D,E,F, G,H,I,J,K,L | 2HDN | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | A | 2VKE | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | A | 2TRT | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | B | 2UXO | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | A,B,D,E,G,H, J,K,L,N,P,Q, R,T | 1I97 | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | A,D,H,N | 1HNW | 0.72 | ![]() |
TAC![]() | TETRACYCLINE | A,B | 2HCJ | 0.72 | ![]() |
789![]() | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.71 | ![]() |
DK2![]() | 2-[(1R)-1-CARBOXY-2-(4-HYDROXYPHENYL)ETHYL]- 1,3-DIOXOISOINDOLINE-5-CARBOXYLIC ACID | A,B | 2PU2 | 0.75 | ![]() |
HC7![]() | (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl- 4-yl]-2-hydroxy-4,4-dimethylmorpholin- 4-ium | A | 3FEG | 0.74 | ![]() |
DTY![]() | D-TYROSINE | A | 1C4B | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,L | 1ZEA | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,B | 1UNO | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A | 2IGZ | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,B | 2Q33 | 0.71 | ![]() |
DTY![]() | D-TYROSINE | H,S | 2H9E | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A | 2IH0 | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A | 1D7T | 0.71 | ![]() |
DTY![]() | D-TYROSINE | A,B | 1XA0 | 0.71 | ![]() |
MTY![]() | META-TYROSINE | A | 2TOH | 0.74 | ![]() |
MTY![]() | META-TYROSINE | A,B | 1BIQ | 0.74 | ![]() |
MTY![]() | META-TYROSINE | A | 1Q7O | 0.74 | ![]() |
ZYA![]() | BENZOYL-TYROSINE-ALANINE-METHYL KETONE | A | 1AIM | 0.72 | ![]() |
TYB![]() | TYROSINAL | A,B | 1KDZ | 0.71 | ![]() |
TYB![]() | TYROSINAL | A | 1Q11 | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 2J5B | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,I | 1GA4 | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B,C | 1NLU | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1KE1 | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1H3F | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1H3E | 0.71 | ![]() |
TYP![]() | CYCLO-(L-TYROSINE-L-PROLINE) INHIBITOR | A,B | 1W1Y | 0.72 | ![]() |
TY3![]() | 3-HYDROXY-L-TYROSINE | A,B | 2VH3 | 0.71 | ![]() |
E20![]() | 1-BENZYL-4-[(5,6-DIMETHOXY-1-INDANON- 2-YL)METHYL]PIPERIDINE | A | 1EVE | 0.73 | ![]() |
MUF![]() | (8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid | A,B | 3BEJ | 0.71 | ![]() |
EQI![]() | EQUILIN | A,B | 1EQU | 0.72 | ![]() |
LOB![]() | LOBELINE | A,B,C,D,E,F, G,H,I,J | 2BYS | 0.81 | ![]() |
GHP![]() | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.72 | ![]() |
MOY![]() | [(4R)-4-(3-HYDROXYPHENYL)-1,6-DIMETHYL- 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN- 5-YL](PHENYL)METHANONE | A,B | 2IEH | 0.77 | ![]() |
3XH![]() | 3-Hydroxyhippuric acid | A | 3E9K | 0.72 | ![]() |
1BA![]() | 4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDE | A | 2GPP | 0.73 | ![]() |
ARY![]() | ARYLOMYCIN A2 | A,B | 1T7D | 0.7 | ![]() |
TYC![]() | L-TYROSINAMIDE | A | 2BF9 | 0.71 | ![]() |
TYC![]() | L-TYROSINAMIDE | A | 2OCI | 0.71 | ![]() |
D4P![]() | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A | 1DSR | 0.72 | ![]() |
D4P![]() | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.72 | ![]() |
D4P![]() | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.72 | ![]() |
YTT![]() | (3S,6S)-3,6-bis(4-hydroxybenzyl)piperazine- 2,5-dione | A | 3G5H | 0.78 | ![]() |
MTB![]() | A,B | 1SRF | 0.71 | ![]() | |
PY9![]() | 4-{[(2R)-2-(2-methylphenyl)pyrrolidin- 1-yl]carbonyl}benzene-1,3-diol | A,B | 3EKR | 0.76 | ![]() |
REN![]() | (S)-reticuline | A | 3FWA | 0.71 | ![]() |
REN![]() | (S)-reticuline | A | 3D2D | 0.71 | ![]() |
Y13![]() | (2E)-3-(3,4-DIHYDROXYPHENYL)-N- [2-(4-HYDROXYPHENYL)ETHYL]ACRYLAMIDE | A | 2EW6 | 0.71 | ![]() |
BCG![]() | 3-(BENZOYLOXY)-8-METHYL-8-AZABICYCLO[3.2.1]OCTANE- 2-CARBOXYLIC ACID | H | 1QYG | 0.7 | ![]() |
156![]() | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.71 | ![]() |
OBE![]() | 3-(3-HYDROXY-BENZOYLOXY)-8-METHYL- 8-AZA-BICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID | H | 1RIV | 0.74 | ![]() |
BM4![]() | 3-[(3R)-3-ethyl-1-{9-[(3S)-3-ethyl- 3-(3-hydroxyphenyl)azepan-1-yl]nonyl}azepan- 3-yl]phenol | X | 2W6C | 0.78 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.71 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | X | 2O48 | 0.71 | ![]() |
AOE![]() | N-BUTYL-11-[(7R,8R,9S,13S,14S,17S)- 3,17-DIHYDROXY-13-METHYL-7,8,9,11,12,13,14,15,16,17- DECAHYDRO-6H-CYCLOPENTA[A]PHENANTHREN- 7-YL]-N-METHYLUNDECANAMIDE | A | 1HJ1 | 0.74 | ![]() |
B3Y![]() | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.71 | ![]() |
B3Y![]() | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.71 | ![]() |
B3Y![]() | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.71 | ![]() |
C1N![]() | N-[(BENZYLOXY)CARBONYL]LEUCYL-N~1~- [3-FLUORO-1-(4-HYDROXYBENZYL)-2- OXOPROPYL]LEUCINAMIDE | A | 1ZCM | 0.7 | ![]() |
3QC![]() | (4R)-4-(3-HYDROXYPHENYL)-N,N,7,8- TETRAMETHYL-3,4-DIHYDROISOQUINOLINE- 2(1H)-CARBOXAMIDE | A,B | 2FME | 0.74 | ![]() |
DAH![]() | 3,4-DIHYDROXYPHENYLALANINE | A,B | 1RNR | 0.71 | ![]() |
DAH![]() | 3,4-DIHYDROXYPHENYLALANINE | A | 6PAH | 0.71 | ![]() |
DAH![]() | 3,4-DIHYDROXYPHENYLALANINE | A,B | 1IVV | 0.71 | ![]() |
DBE![]() | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.74 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.72 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.72 | ![]() |
NLT![]() | N-DODECANOYL-L-TYROSINE | A,B,C,D,E,F, G,H | 2G0B | 0.73 | ![]() |
BJH![]() | 1(R)-1-ACETAMIDO-2-(3-CARBOXY-2- HYDROXYPHENYL)ETHYL BORONIC ACID | A | 1ERQ | 0.71 | ![]() |
EQU![]() | EQUILENIN | A,B | 1OGX | 0.71 | ![]() |
EQU![]() | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.71 | ![]() |
EQU![]() | EQUILENIN | A,B | 1OH0 | 0.71 | ![]() |
EQU![]() | EQUILENIN | A | 1W6Y | 0.71 | ![]() |
EQU![]() | EQUILENIN | A,B | 1CQS | 0.71 | ![]() |
EQU![]() | EQUILENIN | A | 1OGZ | 0.71 | ![]() |
EQU![]() | EQUILENIN | A | 1GS3 | 0.71 | ![]() |
EQU![]() | EQUILENIN | A | 1OHO | 0.71 | ![]() |
BJP![]() | (1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID | A | 1ERO | 0.71 | ![]() |