Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02090569
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 |
INP | 4-[[N-[(PHENYLMETHOXY)CARBONYL]- /NL/N-LEUCYL]AMINO]-1[(2S)-2-[[[4- (PYRIDINYLMETHOXY)CARBONYL]AMINO]- 4-METHYLPENT/NYL]-3-PYRROLIDINONE/N | A | 1AU4 | 0.71 | |
544 | 2-(1-METHYL-3-OXO-3-PHENYL-PROPYLAMINO)- 3-{4-[2-(5-METHYL-2-PHENYL-OXAZOL- 4-YL)-ETHOXY]-PHENYL}-PROPIONIC ACID | A,D | 1K74 | 0.7 | |
544 | 2-(1-METHYL-3-OXO-3-PHENYL-PROPYLAMINO)- 3-{4-[2-(5-METHYL-2-PHENYL-OXAZOL- 4-YL)-ETHOXY]-PHENYL}-PROPIONIC ACID | A,C,E,G | 1K7L | 0.7 | |
CBB | 1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER | B | 1LPK | 0.71 | |
TBV | 3-[2-[[3-(2-CARBOXYETHYL)-5-[[3- ETHENYL-4-METHYL-5-[(2-METHYLPROPAN- 2-YL)OXY]-1H-PYRROL-2-YL]METHYL]- 4-METHYL-1H-PYRROL-2-YL]METHYL]- 5-[(Z)-(4-ETHENYL-3-METHYL-5-OXO- PYRROL-2-YLIDENE)METHYL]-4-METHYL- 1H-PYRROL-3-YL]PROPANOIC ACID | A | 2WD4 | 0.71 | |
VX3 | 2,3-diphenyl-1H-indole-7-carboxylic acid | A | 3BGZ | 0.73 | |
225 | FELODIPINE | A | 2NNJ | 0.75 | |
7HI | (3R,5R)-7-[3-(biphenyl-4-ylcarbamoyl)- 2-ethyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol- 1(4H)-yl]-3,5-dihydroxyheptanoic acid | A,B,C,D | 3CD5 | 0.72 | |
882 | (3R,5R)-7-[5-(ANILINOCARBONYL)- 3,4-BIS(4-FLUOROPHENYL)-1-ISOPROPYL- 1H-PYRROL-2-YL]-3,5-DIHYDROXYHEPTANOIC ACID | A,C,D | 2Q1L | 0.71 | |
882 | (3R,5R)-7-[5-(ANILINOCARBONYL)- 3,4-BIS(4-FLUOROPHENYL)-1-ISOPROPYL- 1H-PYRROL-2-YL]-3,5-DIHYDROXYHEPTANOIC ACID | A,C,D | 3CD7 | 0.71 | |
340 | 5-METHOXY-1,2-DIMETHYL-3-(PHENOXYMETHYL)INDOLE- 4,7-DIONE | A,B,C,D | 1KBO | 0.73 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CQ1 | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1OTW | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1C9U | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1W6S | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1FLG | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1KV9 | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD6 | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CRU | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1H4I | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD7 | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD8 | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,D,I | 2D0V | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 4AAH | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C,E,G | 1H4J | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1KB0 | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1YIQ | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1LRW | 0.77 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1G72 | 0.77 | |
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 | 0.71 | |
ICO | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 0.72 | |
MOC | CARBAMIC ACID 2,6-DIAMINO-5-METHYL- 4,7-DIOXO-2,3,4,7-TETRAHYDRO-1H- 3A-AZA-CYCLOPENTA[A]INDEN-8-YLMETHYL ESTER | A | 199D | 0.76 | |
3DE | 3,5-DIMETHYL-1-PHENYL-1H-PYRAZOLE- 4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2C | 0.71 | |
BH1 | BACTERIOPHEOPHYTIN | H,L,M | 2BOZ | 0.75 | |
BH1 | BACTERIOPHEOPHYTIN | A,B | 2BNS | 0.75 | |
BH1 | BACTERIOPHEOPHYTIN | A,B | 2BNP | 0.75 | |
5DE | 1-(4-AMINOPHENYL)-3,5-DIMETHYL- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2E | 0.7 | |
IDA | (2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO- INDOL-7-YL)ACETIC ACID | A,B | 1OXL | 0.72 | |
FIC | 5-fluoroindole-2-carboxylic acid | A,B | 3DWS | 0.71 | |
OAI | 6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID | A | 1C83 | 0.71 | |
T19 | PHENYLMETHYLENECARBOXY-(METHYLENEAMINO- FORMYL-DIPHENYLMETHYL)METHY-PRO- BOROVAL | H,I | 1AIX | 0.74 | |
570 | 2-(2-BENZOYL-PHENYLAMINO)-3-{4- [2-(5-METHYL-2-PHENYL-OXAZOL-4- YL)-ETHOXY]-PHENYL}-PROPIONIC ACID | A,D | 1RDT | 0.7 | |
570 | 2-(2-BENZOYL-PHENYLAMINO)-3-{4- [2-(5-METHYL-2-PHENYL-OXAZOL-4- YL)-ETHOXY]-PHENYL}-PROPIONIC ACID | A,D | 1FM9 | 0.7 | |
ARH | 3-(HYDROXYMETHYL)-1-METHYL-5-(2- METHYLAZIRIDIN-1-YL)-2-PHENYL-1H- INDOLE-4,7-DIONE | A,B,C,D | 1H69 | 0.74 | |
1IQ | 2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID | A | 1Z8N | 0.72 | |
C80 | (2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)- 5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1- BENZYL-1H-INDOLE-3-CARBOXYLATE | C,O | 2V11 | 0.74 | |
I4A | 5-(3-carbamoylbenzyl)-5,6,7,8,9,10- hexahydrocyclohepta[b]indole-4- carboxylic acid | A | 3FR5 | 0.71 | |
BIN | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 1C8L | 0.72 | |
BIN | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 2AMV | 0.72 | |
BIN | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 3AMV | 0.72 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 3PRC | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 6PRC | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1RY5 | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1RZH | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | L,M,R,S | 1RZZ | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | L,M,R,S | 1S00 | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 2JBL | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 1VRN | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 7PRC | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 2PRC | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1UMX | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 1R2C | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 3D38 | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 2I5N | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 5PRC | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 1PRC | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1RVJ | 0.76 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M,U | 1DXR | 0.76 | |
117 | 7-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL- 3-PHENYL-4-PHENYLCARBAMOYL-PYRROL- 1-YL]- 3,5-DIHYDROXY-HEPTANOIC ACID | A,B,C,D | 1HWK | 0.71 | |
E09 | 3-HYDROXYMETHYL-5-AZIRIDINYL-1METHYL- 2-[1H-INDOLE-4,7-DIONE]-PROPANOL | A,B,C,D | 1GG5 | 0.72 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RG5 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWT | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | 1,2,3,5,6,7, 8,A,B,D,E,F, G,H,I,J,K,L, M,N,P,R,S,T, U,V,W,Y | 1PYH | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | A,B,C | 1Z9K | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UXK | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RY5 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RZH | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | C,H,L,M | 1EYS | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWS | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 4RCR | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1K6N | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1YF6 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UX5 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DTS | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | C | 1E14 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DTA | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1PST | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1KBY | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | C,H,L,M | 1L9B | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 2RCR | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1PCR | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1M3X | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HJ6 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M,R,S,T | 1DS8 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1FNQ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UXJ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1QOV | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DU3 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UX4 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,R,S | 1AIJ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,N,O | 1AIG | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RGN | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGX | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWV | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RQK | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M,R,S,T | 1DV6 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWW | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,R,S | 1RZZ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,R,S | 1S00 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HG3 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UX3 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1OGV | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DUQ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | A,B | 1Z9J | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2GNU | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | C | 1E6D | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1MPS | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,X | 2UXM | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RVJ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UXL | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | C,D,L,M,R,S | 1L9J | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 2JJ0 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JH0 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2GMR | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DU2 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1PSS | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HG9 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HIT | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2JIY | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWU | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGZ | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2J8C | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M,R,S,T | 1DV3 | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DSY | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1F6N | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1FNP | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1K6L | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HHK | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGW | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2J8D | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1YST | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DTR | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGY | 0.76 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HH1 | 0.76 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,H, K,L,T,V,Z | 3A0H | 0.75 | |
PHO | PHEOPHYTIN A | Z | 1W5C | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,H, I,K,L,M,T,V,X | 2AXT | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,H, J,K,L,T,V,Z | 3A0B | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,F, H,I,J,K,M,O, T,V,Z | 3BZ1 | 0.75 | |
PHO | PHEOPHYTIN A | 0,A,B,C,D,E, G,J,K,L,M,N, P,R,V,W | 1IZL | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,F, J,K,V | 1S5L | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,G, H,I,J,K,L,M, O,P,Q,R | 1ILX | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,G, H,I,J,K,L,M, O,P,Q,R | 1FE1 | 0.75 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,F, H,I,J,K,L,M, O,T,V,X,Z | 3BZ2 | 0.75 | |
NA4 | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.71 |