Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00187431
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 |
BN4![]() | 4-[4-({[(2,4-DICHLOROBENZOYL)AMINO]CARBONYL}AMINO)- 2,3-DIMETHYLPHENOXY]BUTANOIC ACID | A | 1WV0 | 0.7 | ![]() |
CXN![]() | CLOXACILLIN | A,B | 1FCM | 0.73 | ![]() |
6C3![]() | 6-CHLORO-3-(3-METHYLISOXAZOL-5- YL)-4-PHENYLQUINOLIN-2(1H)-ONE | A | 2I0V | 0.8 | ![]() |
UC2![]() | N-[4-CLORO-3-(T-BUTYLOXOME)PHENYL- 2-METHYL-3-FURAN-CARBOTHIAMIDE | A | 1RT5 | 0.73 | ![]() |
617![]() | 2-{[(4-CHLOROPHENOXY)ACETYL]AMINO}BENZOIC ACID | A | 2QE5 | 0.73 | ![]() |
GFA![]() | 2-[4-chloro-2-(phenylcarbonyl)phenoxy]- N-phenylacetamide | A | 3DLE | 0.72 | ![]() |
SOY![]() | OXACILLIN-ACYLATED SERINE | A | 2IWD | 0.71 | ![]() |
064![]() | 3-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophenyl)- 5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid | A | 3DCT | 0.76 | ![]() |
2EQ![]() | 5-(5-chloro-2,4-dihydroxyphenyl)- N-ethyl-4-[4-(morpholin-4-ylmethyl)phenyl]isoxazole- 3-carboxamide | A | 2VCJ | 0.72 | ![]() |
O62![]() | 6-(4-{[3-(2,6-dichlorophenyl)-5- (1-methylethyl)isoxazol-4-yl]methoxy}phenyl)naphthalene- 1-carboxylic acid | A | 3DCU | 0.73 | ![]() |
679![]() | 2-CHLORO-5-[4-(3-CHLORO-PHENYL)- 2,5-DIOXO-2,5-DIHYDRO-1H-PYRROL- 3-YLAMINO]-BENZOIC ACID | A,B | 1Q4L | 0.7 | ![]() |
393![]() | (5-CHLORO-2-{[(3-NITROBENZYL)AMINO]CARBONYL}PHENOXY)ACETIC ACID | A | 2PDU | 0.72 | ![]() |
393![]() | (5-CHLORO-2-{[(3-NITROBENZYL)AMINO]CARBONYL}PHENOXY)ACETIC ACID | A | 2PDC | 0.72 | ![]() |
393![]() | (5-CHLORO-2-{[(3-NITROBENZYL)AMINO]CARBONYL}PHENOXY)ACETIC ACID | A | 2PDP | 0.72 | ![]() |
393![]() | (5-CHLORO-2-{[(3-NITROBENZYL)AMINO]CARBONYL}PHENOXY)ACETIC ACID | A | 2PZN | 0.72 | ![]() |
393![]() | (5-CHLORO-2-{[(3-NITROBENZYL)AMINO]CARBONYL}PHENOXY)ACETIC ACID | A | 2PDJ | 0.72 | ![]() |
393![]() | (5-CHLORO-2-{[(3-NITROBENZYL)AMINO]CARBONYL}PHENOXY)ACETIC ACID | A | 2IKJ | 0.72 | ![]() |
W43![]() | 5-(7-(6-CHLORO-4-(5-HYDRO-4-METHYL- 2-OXAZOLYL)PHENOXY)HEPTYL)-3-METHYL ISOXAZOLE | 1 | 2RM2 | 0.7 | ![]() |
UC4![]() | 1-METHYL ETHYL 1-CHLORO-5-[[(5,6DIHYDRO- 2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL]AMINO]BENZOATE | A | 1RT7 | 0.74 | ![]() |
136![]() | N-(4-CARBAMIMIDOYL-3-CHORO-PHENYL)- 2-HYDROXY-3-IODO-5-METHYL-BENZAMIDE | B | 1GJD | 0.72 | ![]() |
643![]() | 6-(4-{[3-(3,5-dichloropyridin-4- yl)-5-(1-methylethyl)isoxazol-4- yl]methoxy}-2-methylphenyl)-1-methyl- 1H-indole-3-carboxylic acid | A | 3FXV | 0.71 | ![]() |
19B![]() | 4-methyl-N-(3-morpholin-4-ylphenyl)- 3-(3-piperidin-4-yl-1,2-benzisoxazol- 6-yl)benzamide | A | 3E93 | 0.72 | ![]() |
PXB![]() | parecoxib | A | 2ZMB | 0.72 | ![]() |
GNI![]() | (3-{4-[2-(2,4-DICHLORO-PHENOXY)- ETHYLCARBAMOYL]-5-PHENYL-ISOXAZOL- 3-YL}-PHENYL)-ACETIC ACID | A,B | 2J14 | 0.8 | ![]() |
IMN![]() | INDOMETHACIN | A | 2BXM | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 3FO7 | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A,B,C,D | 1Z9H | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 2BXQ | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A,B,C,D | 4COX | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 2ALT | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 2OTH | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A,B | 2DM6 | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 1S2A | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 2ZB8 | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 3HWZ | 0.71 | ![]() |
IMN![]() | INDOMETHACIN | A | 2BXK | 0.71 | ![]() |
AG7![]() | 4-{2-(4-FLUORO-BENZYL)-6-METHYL- 5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)- AMINO]-4-OXO-HEPTANOYLAMINO}-5- (2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER | A | 1CQQ | 0.73 | ![]() |
UC3![]() | 1-METHYL ETHYL 2-CHLORO-5-[[[(1- METHYLETHOXY)THIOOXO]METHYL]AMINO]- BENZOATE | A | 1RT6 | 0.71 | ![]() |
105![]() | N-[5-METHYL-3-O-TOLYL-ISOXAZOLE- 4-CARBOXYLIC ACID AMIDE] BORONIC ACID | A | 1JWZ | 0.81 | ![]() |
105![]() | N-[5-METHYL-3-O-TOLYL-ISOXAZOLE- 4-CARBOXYLIC ACID AMIDE] BORONIC ACID | A,B | 1FSY | 0.81 | ![]() |
105![]() | N-[5-METHYL-3-O-TOLYL-ISOXAZOLE- 4-CARBOXYLIC ACID AMIDE] BORONIC ACID | A | 1NYY | 0.81 | ![]() |
RXC![]() | (1S)-1-(3-chlorophenyl)-2-oxo-2- [(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin- 5-yl)amino]ethyl acetate | A,B,C,D | 3DEJ | 0.71 | ![]() |
BN2![]() | 7-[2,6-DICHLORO-4-({[(2-CHLOROBENZOYL)AMINO]CARBONYL}AMINO)PHENOXY]HEPTANOIC ACID | A | 1WUT | 0.7 | ![]() |
CXZ![]() | 4-chloro-6-{5-[(2-morpholin-4-ylethyl)amino]- 1,2-benzisoxazol-3-yl}benzene-1,3- diol | A | 3BMY | 0.73 | ![]() |
2GG![]() | 5-(5-CHLORO-2,4-DIHYDROXYPHENYL)- N-ETHYL-4-(4-METHOXYPHENYL)ISOXAZOLE- 3-CARBOXAMIDE | A | 2UWD | 0.74 | ![]() |
3IH![]() | N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL- L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)- 4-OXO-1-{[(3R)-2-OXOPYRROLIDIN- 3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE | A | 2HOB | 0.75 | ![]() |
3IH![]() | N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL- L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)- 4-OXO-1-{[(3R)-2-OXOPYRROLIDIN- 3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE | A,B | 2AMQ | 0.75 | ![]() |
3IH![]() | N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL- L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)- 4-OXO-1-{[(3R)-2-OXOPYRROLIDIN- 3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE | A,B,C,D | 3D23 | 0.75 | ![]() |
3IH![]() | N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL- L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)- 4-OXO-1-{[(3R)-2-OXOPYRROLIDIN- 3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE | A,B | 2Q6F | 0.75 | ![]() |