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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01706738

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3IL3-(INDOL-3-YL) LACTATEA2A7P0.71
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.7
IMM1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-
3-ACETIC ACID
A,B1PGF0.75
IMM1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-
3-ACETIC ACID
A,B1PGG0.75
3EA2-{5-[3-(7-PROPYL-3-TRIFLUOROMETHYLBENZO[D]ISOXAZOL-
6-YLOXY)PROPOXY]INDOL-1-YL}ETHANOIC ACID
A,B2ATH0.73
CIA6-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,B1UDU0.71
CIA6-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
A1XOZ0.71
VX32,3-diphenyl-1H-indole-7-carboxylic acidA3BGZ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.74
BPHBACTERIOPHEOPHYTIN A1,2,3,5,6,7,
8,A,B,D,E,F,
G,H,I,J,K,L,
M,N,P,R,S,T,
U,V,W,Y
1PYH0.74
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.74
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.74
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.74
BPHBACTERIOPHEOPHYTIN AL,M1YF60.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.74
BPHBACTERIOPHEOPHYTIN AC1E140.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.74
BPHBACTERIOPHEOPHYTIN AL,M1PST0.74
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.74
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.74
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.74
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.74
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.74
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.74
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.74
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.74
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.74
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.74
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.74
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.74
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.74
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.74
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.74
BPHBACTERIOPHEOPHYTIN AC1E6D0.74
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.74
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.74
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.74
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.74
BPHBACTERIOPHEOPHYTIN AL,M1JH00.74
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.74
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.74
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.74
BPHBACTERIOPHEOPHYTIN AL,M1YST0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.74
V5X(2R)-N~8~-HYDROXY-2-{[(5-METHOXY-
2-METHYL-1H-INDOL-3-YL)ACETYL]AMINO}-
N~1~-[2-(2-PHENYL-1H-INDOL-3-YL)ETHYL]OCTANEDIAMIDE
A,B2V5X0.74
ICO1H-INDOLE-3-CARBOXYLIC ACIDL2PIP0.75
IOGN-[(1R)-3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]-
2-[2-PHENYL-6-(2-PIPERIDIN-1-YLETHOXY)-
1H-INDOL-3-YL]ACETAMIDE
A2IOG0.71
IMS2-[1-(4-CHLOROBENZOYL)-5-METHOXY-
2-METHYL-1H-INDOL-3-YL]-N-[(1S)-
1-(HYDROXYMETHYL)PROPYL]ACETAMIDE
P2OYU0.71
IM82-[1-(4-CHLOROBENZOYL)-5-METHOXY-
2-METHYL-1H-INDOL-3-YL]-N-[(1R)-
1-(HYDROXYMETHYL)PROPYL]ACETAMIDE
P2OYE0.71
CRR3,4-DI-1H-INDOL-3-YL-1H-PYRROLE-
2,5-DICARBOXYLIC ACID
A2Z3U0.71
3309-HYDROXY-6-(3-HYDROXYPROPYL)-4-
(2-METHOXYPHENYL)PYRROLO[3,4-C]CARBAZOLE-
1,3(2H,6H)-DIONE
A2IO60.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.74
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.74
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.74
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.74
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.74
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.74
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.74
VLB(2ALPHA,2'BETA,3BETA,4ALPHA,5BETA)-
VINCALEUKOBLASTINE
A,B,C,D1Z2B0.71
7833-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-5-METHOXY-1,1'-BIPHENYL-2-
OLATE
A1O2T0.71
OAI6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACIDA1C830.72
I3N1-BENZYL-5-METHOXY-2-METHYL-1H-
INDOL-3-YL)-ACETIC ACID
A1DCY0.73
4HT4-HYDROXYTRYPTOPHANH,L1RU90.73
4HT4-HYDROXYTRYPTOPHANH,L1RUM0.73
4HT4-HYDROXYTRYPTOPHANH,L1RUL0.73
4HT4-HYDROXYTRYPTOPHANH,L1RUA0.73
FIC5-fluoroindole-2-carboxylic acidA,B3DWS0.72
3IHN-[(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
A2HOB0.71
3IHN-[(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,B2AMQ0.71
3IHN-[(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,D3D230.71
3IHN-[(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,B2Q6F0.71
6436-(4-{[3-(3,5-dichloropyridin-4-
yl)-5-(1-methylethyl)isoxazol-4-
yl]methoxy}-2-methylphenyl)-1-methyl-
1H-indole-3-carboxylic acid
A3FXV0.72
IDA(2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO-
INDOL-7-YL)ACETIC ACID
A,B1OXL0.71
ML1N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamideA,B2QX40.71
ML1N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamideA,B2QX60.71
ML1N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamideA,B2QWX0.71
A535-{5-[(S)-2-AMINO-3-(1H-INDOL-3-
YL)-PROPOXYL]-PYRIDIN-3-YL}-3-[1-
(1H-PYRROL-2-YL)-METH-(Z)-YLIDENE]-
1,3-DIHYDRO-INDOL-2-ONE
A2GHG0.71
FLXN-[(FURAN-2-YL)CARBONYL]-(S)-LEUCYL-
(R)-[1-AMINO-2(1H-INDOL-3-YL)ETHYL]-
PHOSPHONIC ACID
A4AIG0.71
PLT[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-
PYRIDIN-4-YLMETHYL]-L-TRYPTOPHANE
B2TYS0.7
IAC1H-INDOL-3-YLACETIC ACIDB2P1Q0.7
IAC1H-INDOL-3-YLACETIC ACIDA2OYF0.7
IAC1H-INDOL-3-YLACETIC ACIDA,B3FVU0.7
IAC1H-INDOL-3-YLACETIC ACIDB2P1P0.7
TRX6-HYDROXYTRYPTOPHANA,B,C,I,J,L,M1K830.73
TRX6-HYDROXYTRYPTOPHANA,B,C,I,J,L,
M,T
2VUM0.73
TRX6-HYDROXYTRYPTOPHANA,B,C,I,J,L,M3CQZ0.73
ET03-(5-methoxy-1H-indol-3-yl)propanoic acidA,B3ET00.74
AG74-{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
A1CQQ0.71
6IN4-(1-BENZYL-3-CARBAMOYLMETHYL-2-
METHYL-1H-INDOL-5-YLOXY)-BUTYRIC ACID
A1DB50.74
8249-HYDROXY-4-PHENYLPYRROLO[3,4-C]CARBAZOLE-
1,3(2H,6H)-DIONE
A1X8B0.74
240(2S)-2-(2-{[1-(4-METHOXYBENZOYL)-
2-METHYL-5-(TRIFLUOROMETHOXY)-1H-
INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID
A,B2Q590.75
IMNINDOMETHACINA2BXM0.73
IMNINDOMETHACINA3FO70.73
IMNINDOMETHACINA,B,C,D1Z9H0.73
IMNINDOMETHACINA2BXQ0.73
IMNINDOMETHACINA,B,C,D4COX0.73
IMNINDOMETHACINA2ALT0.73
IMNINDOMETHACINA2OTH0.73
IMNINDOMETHACINA,B2DM60.73
IMNINDOMETHACINA1S2A0.73
IMNINDOMETHACINA2ZB80.73
IMNINDOMETHACINA3HWZ0.73
IMNINDOMETHACINA2BXK0.73
C03(2R)-2-(4-CHLORO-3-{[3-(6-METHOXY-
1,2-BENZISOXAZOL-3-YL)-2-METHYL-
6-(TRIFLUOROMETHOXY)-1H-INDOL-1-
YL]METHYL}PHENOXY)PROPANOIC ACID
A,B2P4Y0.73
9365-METHOXY-1,2-DIMETHYL-3-(4-NITROPHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBQ0.74
HTRBETA-HYDROXYTRYPTOPHANEA,B1QPA0.7
HTRBETA-HYDROXYTRYPTOPHANEA,B1B800.7
HTRBETA-HYDROXYTRYPTOPHANEA1ROV0.7
C80(2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-
5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-
BENZYL-1H-INDOLE-3-CARBOXYLATE
C,O2V110.72
43A(3Z)-6-(4-HYDROXY-3-METHOXYPHENYL)-
3-(1H-PYRROL-2-YLMETHYLENE)-1,3-
DIHYDRO-2H-INDOL-2-ONE
A2AYP0.71
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.7
3405-METHOXY-1,2-DIMETHYL-3-(PHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBO0.71
JTPN-[(13-CYCLOHEXYL-6,7-DIHYDROINDOLO[1,2-
D][1,4]BENZOXAZEPIN-10-YL)CARBONYL]-
2-METHYL-L-ALANINE
A,B2DXS0.71
DUO4-HYDROXY-2,8-DIMETHYL-1-OXO-6-
(4,5,6-TRIMETHOXY-1H-INDOLE-2-CARBONYL)-
1,2,3,6,7,8-HEXAHYDRO-3,6-DIAZA-
AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
B107D0.7
7CK7-carboxy-5-hydroxy-12,13-dihydro-
6H-indolo[2,3-a]pyrrolo[3,4-c]carbazole
A,B2R0G0.71
678(3-{5-[AMINO(IMINIO)METHYL]-1H-
INDOL-2-YL}-5-BROMO-4-OXIDOPHENYL)ACETATE
A1O3L0.71
8IN[3-(1-BENZYL-3-CARBAMOYLMETHYL-
2-METHYL-1H-INDOL-5-YLOXY)-PROPYL-
]-PHOSPHONIC ACID
A1DB40.72
CBB1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-
2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-
BENZYLESTER
B1LPK0.72
ML2N-[2-(2-iodo-5-methoxy-1H-indol-
3-yl)ethyl]acetamide
A,B2QX90.73
ML2N-[2-(2-iodo-5-methoxy-1H-indol-
3-yl)ethyl]acetamide
A,B2QX80.73
BH1BACTERIOPHEOPHYTINH,L,M2BOZ0.71
BH1BACTERIOPHEOPHYTINA,B2BNS0.71
BH1BACTERIOPHEOPHYTINA,B2BNP0.71
5MRNALPHA-{(2S)-3-[(S)-HYDROXY(PHENYL)PHOSPHORYL]-
2-[(3-PHENYLISOXAZOL-5-YL)METHYL]PROPANOYL}-
L-TRYPTOPHANAMIDE
A,B2OVZ0.72
CR32-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE
A1O2H0.71
DRY[(1-{3-[(6-BENZOYL-1-PROPYL-2-NAPHTHYL)OXY]PROPYL}-
1H-INDOL-5-YL)OXY]ACETIC ACID
A2HWQ0.73
DSI4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-
8-METHYL-3,6,7,8-TETRAHYDRO-3,6-
DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
B1DSI0.73
PHOPHEOPHYTIN AA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.74
PHOPHEOPHYTIN AZ1W5C0.74
PHOPHEOPHYTIN AA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.74
PHOPHEOPHYTIN AA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.74
PHOPHEOPHYTIN A0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
J,K,V
1S5L0.74
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.74
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1FE10.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.74
HRP5-HYDROXY-L-TRYPTOPHANB1YIA0.72
YPA(S)-3-(4-(2-CARBAZOL-9-YL-ETHOXY)-
PHENYL)-2-ETHOXY-PROPIONIC ACID
A1KNU0.72
DRD2-[(1-{3-[(6-BENZOYL-1-PROPYL-2-
NAPHTHYL)OXY]PROPYL}-1H-INDOL-4-
YL)OXY]-2-METHYLPROPANOIC ACID
A2HWR0.73
CAU(2S)-1-(9H-Carbazol-4-yloxy)-3-
(isopropylamino)propan-2-ol
A2RH10.73
TRO2-HYDROXY-TRYPTOPHANA1KB00.73
TRO2-HYDROXY-TRYPTOPHANA1G3P0.73
IOKN-[(1R)-3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]-
2-(2-PHENYL-1H-INDOL-3-YL)ACETAMIDE
A,B2IOK0.71
8393-(9-HYDROXY-1,3-DIOXO-4-PHENYL-
2,3-DIHYDROPYRROLO[3,4-C]CARBAZOL-
6(1H)-YL)PROPANOIC ACID
A2IN60.73
241(2S)-2-(3-{[1-(4-METHOXYBENZOYL)-
2-METHYL-5-(TRIFLUOROMETHOXY)-1H-
INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID
A,B2Q5P0.75
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.7
3CS3-[3-(3,3-DIMETHYLBUTANOYL)-1-(4-
IODOBENZYL)-5-(QUINOLIN-2-YLMETHOXY)-
1H-INDOL-2-YL]-2,2-DIMETHYLPROPANOIC ACID
A,B,C,D,E,F2Q7R0.72
W032,6-DIMETHYL-1-(3-[3-METHYL-5-ISOXAZOLYL]-
PROPANYL)-4-[2-METHYL-4-ISOXAZOLYL]-
PHENOL
1,41QJY0.71