Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01360225
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 |
BH1 | BACTERIOPHEOPHYTIN | H,L,M | 2BOZ | 0.72 | |
BH1 | BACTERIOPHEOPHYTIN | A,B | 2BNS | 0.72 | |
BH1 | BACTERIOPHEOPHYTIN | A,B | 2BNP | 0.72 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1QPA | 0.71 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1B80 | 0.71 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A | 1ROV | 0.71 | |
CIA | 6-BENZO[1,3]DIOXOL-5-YL-2-METHYL- 2,3,6,7,12,12A-HEXAHYDRO-PYRAZINO[1',2':1,6]PYRIDO[3,4- B]INDOLE-1,4-DIONE | A,B | 1UDU | 0.71 | |
CIA | 6-BENZO[1,3]DIOXOL-5-YL-2-METHYL- 2,3,6,7,12,12A-HEXAHYDRO-PYRAZINO[1',2':1,6]PYRIDO[3,4- B]INDOLE-1,4-DIONE | A | 1XOZ | 0.71 | |
8CA | 9-benzyl-2,3,4,9-tetrahydro-1H- carbazole-8-carboxylic acid | A | 3FR2 | 0.71 | |
JTP | N-[(13-CYCLOHEXYL-6,7-DIHYDROINDOLO[1,2- D][1,4]BENZOXAZEPIN-10-YL)CARBONYL]- 2-METHYL-L-ALANINE | A,B | 2DXS | 0.72 | |
IQZ | (12bS)-1,2,3,4,12,12b-hexahydroindolo[2,3- a]quinolizin-7(6H)-one | A | 1S1J | 0.74 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 3PRC | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 6PRC | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1RY5 | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1RZH | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | L,M,R,S | 1RZZ | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | L,M,R,S | 1S00 | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 2JBL | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 1VRN | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 7PRC | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 2PRC | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1UMX | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 1R2C | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 3D38 | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 2I5N | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 5PRC | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M | 1PRC | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | H,L,M | 1RVJ | 0.75 | |
BPB | BACTERIOPHEOPHYTIN B | C,H,L,M,U | 1DXR | 0.75 | |
ICO | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 0.74 | |
POO | 3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN- 3-YL)METHYL]AMINO}-2-OXOETHYL)- 2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID | A | 2BRL | 0.7 | |
OAI | 6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID | A | 1C83 | 0.72 | |
TRO | 2-HYDROXY-TRYPTOPHAN | A | 1KB0 | 0.71 | |
TRO | 2-HYDROXY-TRYPTOPHAN | A | 1G3P | 0.71 | |
I4A | 5-(3-carbamoylbenzyl)-5,6,7,8,9,10- hexahydrocyclohepta[b]indole-4- carboxylic acid | A | 3FR5 | 0.74 | |
550 | methyl (1R,2S)-2-(hydroxycarbamoyl)- 1-{4-[(2-methylquinolin-4-yl)methoxy]benzyl}cyclopropanecarboxylate | A,B | 3EDZ | 0.71 | |
VX3 | 2,3-diphenyl-1H-indole-7-carboxylic acid | A | 3BGZ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RG5 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWT | 0.75 | |
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 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | A,B,C | 1Z9K | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UXK | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RY5 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RZH | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | C,H,L,M | 1EYS | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWS | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 4RCR | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1K6N | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1YF6 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UX5 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DTS | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | C | 1E14 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DTA | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1PST | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1KBY | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | C,H,L,M | 1L9B | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 2RCR | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1PCR | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1M3X | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HJ6 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M,R,S,T | 1DS8 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1FNQ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UXJ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1QOV | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DU3 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UX4 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,R,S | 1AIJ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,N,O | 1AIG | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RGN | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGX | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWV | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RQK | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M,R,S,T | 1DV6 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWW | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,R,S | 1RZZ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,R,S | 1S00 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HG3 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UX3 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1OGV | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DUQ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | A,B | 1Z9J | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2GNU | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | C | 1E6D | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1MPS | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M,X | 2UXM | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1RVJ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UXL | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | C,D,L,M,R,S | 1L9J | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 2JJ0 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JH0 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2GMR | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DU2 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1PSS | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HG9 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HIT | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2JIY | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2UWU | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGZ | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2J8C | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M,R,S,T | 1DV3 | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DSY | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1F6N | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1FNP | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 1K6L | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HHK | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGW | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2J8D | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1YST | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 3DTR | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | L,M | 1JGY | 0.75 | |
BPH | BACTERIOPHEOPHYTIN A | H,L,M | 2HH1 | 0.75 | |
ARH | 3-(HYDROXYMETHYL)-1-METHYL-5-(2- METHYLAZIRIDIN-1-YL)-2-PHENYL-1H- INDOLE-4,7-DIONE | A,B,C,D | 1H69 | 0.71 | |
RXB | (1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo- 1,2,3,4-tetrahydroisoquinolin-5- yl)amino]ethyl acetate | A,B,C,D | 3DEI | 0.72 | |
QND | QUINALDIC ACID | A,B | 1IDA | 0.71 | |
FIC | 5-fluoroindole-2-carboxylic acid | A,B | 3DWS | 0.74 | |
BRF | A | 1UUO | 0.72 | ||
3IO | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | A,B,C,D | 1XES | 0.71 | |
3IO | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | B,C,D | 1XET | 0.71 | |
6IN | 4-(1-BENZYL-3-CARBAMOYLMETHYL-2- METHYL-1H-INDOL-5-YLOXY)-BUTYRIC ACID | A | 1DB5 | 0.71 | |
BRE | 2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID | A | 1D3G | 0.73 | |
CLI | 3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID | A,F | 1LEV | 0.71 | |
1IQ | 2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID | A | 1Z8N | 0.74 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CQ1 | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1OTW | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1C9U | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1W6S | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1FLG | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1KV9 | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD6 | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CRU | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1H4I | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD7 | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD8 | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,D,I | 2D0V | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 4AAH | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C,E,G | 1H4J | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1KB0 | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1YIQ | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1LRW | 0.82 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1G72 | 0.82 | |
IQA | (5-OXO-5,6-DIHYDRO-INDOLO[1,2-A]QUINAZOLIN- 7-YL)-ACETIC ACID | A | 1OM1 | 0.7 | |
2S8 | (2S)-8-[(tert-butoxycarbonyl)amino]- 2-(1H-indol-3-yl)octanoic acid | B | 3C6N | 0.7 | |
340 | 5-METHOXY-1,2-DIMETHYL-3-(PHENOXYMETHYL)INDOLE- 4,7-DIONE | A,B,C,D | 1KBO | 0.71 | |
CRR | 3,4-DI-1H-INDOL-3-YL-1H-PYRROLE- 2,5-DICARBOXYLIC ACID | A | 2Z3U | 0.72 | |
TCR | CYCLOMETHYLTRYPTOPHAN | A | 3AIG | 0.71 | |
IID | N-(1-ISOPROPYLPIPERIDIN-4-YL)-1- (3-METHOXYBENZYL)-1H-INDOLE-2-CARBOXAMIDE | A,B | 2BQ7 | 0.72 | |
KAW | N-{(5S)-4,4-dihydroxy-6-phenyl- 5-[(phenylcarbonyl)amino]hexanoyl}- L-tryptophan | A | 3BKL | 0.7 | |
CMM | 2-[2-(1-CARBAMIMIDOYL-PIPERIDIN- 3-YL)-ACETYLAMINO]-3-{4-[2-(3-OXALYL- 1H-INDOL-7-YL)ETHYL]-PHENYL}-PROPIONIC ACID METHYL ESTER | A,B | 1M49 | 0.71 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,H, K,L,T,V,Z | 3A0H | 0.74 | |
PHO | PHEOPHYTIN A | Z | 1W5C | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,H, I,K,L,M,T,V,X | 2AXT | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,H, J,K,L,T,V,Z | 3A0B | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,F, H,I,J,K,M,O, T,V,Z | 3BZ1 | 0.74 | |
PHO | PHEOPHYTIN A | 0,A,B,C,D,E, G,J,K,L,M,N, P,R,V,W | 1IZL | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,F, J,K,V | 1S5L | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,G, H,I,J,K,L,M, O,P,Q,R | 1ILX | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,F,G, H,I,J,K,L,M, O,P,Q,R | 1FE1 | 0.74 | |
PHO | PHEOPHYTIN A | A,B,C,D,E,F, H,I,J,K,L,M, O,T,V,X,Z | 3BZ2 | 0.74 | |
CBB | 1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER | B | 1LPK | 0.75 | |
IMM | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE- 3-ACETIC ACID | A,B | 1PGF | 0.71 | |
IMM | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE- 3-ACETIC ACID | A,B | 1PGG | 0.71 | |
CMF | 3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL- 2-OXOETHYL)-2-PHENYL-1H-INDOLE- 6-CARBOXYLIC ACID | A | 2BRK | 0.72 | |
541 | (2R)-N-HYDROXY-2-[(3S)-3-METHYL- 3-{4-[(2-METHYLQUINOLIN-4-YL)METHOXY]PHENYL}- 2-OXOPYRROLIDIN-1-YL]PROPANAMIDE | A,B | 2FV5 | 0.71 | |
IDA | (2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO- INDOL-7-YL)ACETIC ACID | A,B | 1OXL | 0.73 | |
2S2 | (2S)-2-(1H-indol-3-yl)hexanoic acid | B | 3C6O | 0.7 | |
SNX | 2-[(2-methoxyethyl)amino]-4-(4- oxo-1,2,3,4-tetrahydro-9H-carbazol- 9-yl)benzamide | A | 3D0B | 0.7 | |
3CS | 3-[3-(3,3-DIMETHYLBUTANOYL)-1-(4- IODOBENZYL)-5-(QUINOLIN-2-YLMETHOXY)- 1H-INDOL-2-YL]-2,2-DIMETHYLPROPANOIC ACID | A,B,C,D,E,F | 2Q7R | 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 | 0.75 | |
225 | FELODIPINE | A | 2NNJ | 0.71 | |
642 | (1S,3R,6S)-4-oxo-6-{4-[(2-phenylquinolin- 4-yl)methoxy]phenyl}-5-azaspiro[2.4]heptane- 1-carboxylic acid | A,B | 3EWJ | 0.7 |