Indole

Indole

SCHEMBL29418271

O.c1ccc2[nH]ccc2c1

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Indole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 known ✓ P09874 1/20 0.44
MEN1 known ✓ O00255 1/20 0.40
AHR P35869 7/20 0.94
CA1 P00915 2/20 0.94
CA4 P22748 2/20 0.94
CA6 P23280 2/20 0.94
TRPA1 O75762 1/20 0.94
CA2 P00918 1/20 0.94
ITGB2 P05107 1/20 0.94
ICAM1 P05362 1/20 0.94
ITGAL P20701 1/20 0.94
ADK P55263 1/20 0.94
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.46
IMPDH2 P12268 1/20 0.45
IMPDH1 P20839 1/20 0.45
CYP2A6 P11509 3/20 0.44
NR4A2 P43354 2/20 0.44
CMA1 P23946 1/20 0.44
F7 P08709 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Indole SCHEMBL4364385 1.00 AHR (0.94) AHRCA1CA4CA6TRPA1
Indole SCHEMBL3538342 1.00 AHR (0.94) AHRCA1CA4CA6TRPA1
Indole SCHEMBL29800701 0.97 AHR (0.90) AHRCA1CA4CA6TRPA1
Indole SCHEMBL9215713 0.97 AHR (0.90) AHRCA1CA4CA6TRPA1
Indole SCHEMBL9215718 0.97 AHR (0.90) AHRCA1CA4CA6TRPA1
Indole SCHEMBL27455365 0.97 AHR (0.90) AHRCA1CA4CA6TRPA1
Indole SCHEMBL30250492 0.97
Indole SCHEMBL29352896 0.97
Indole SCHEMBL30463845 0.97
Indole SCHEMBL698 0.97

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117627080-A Deep water bridge pile foundation construction monitoring method and device 广东省装饰有限公司 2024-03-01 CN claimed
CN-119464322-A Application of yncJ gene in regulation and control of salmonella typhimurium virulence 山东农业大学 2025-02-18 CN disclosed
CN-220748242-U Pressure measuring device in drilling high-pressure water pressure test section 浙江华东建设工程有限公司 2024-04-09 CN disclosed
CN-117627080-A Deep water bridge pile foundation construction monitoring method and device 广东省装饰有限公司 2024-03-01 CN disclosed
EP-4308121-A1 THERAPEUTIC CONJUGATES Totus Medicines Inc. (US) 2024-01-24 EP disclosed
EP-4210766-A1 THERAPEUTIC CONJUGATES Totus Medicines Inc. (US) 2023-07-19 EP disclosed
EP-4211510-A1 METHODS AND SYSTEMS FOR MAKING AN OPTICAL FUNCTIONAL FILM Hsu, Roger Wen Yi (US) 2023-07-19 EP disclosed
US-20230150215-A1 METHODS AND SYSTEMS FOR MAKING AN OPTICAL FUNCTIONAL FILM HSU ROGER WEN YI (US) 2023-05-18 US disclosed
US-11541616-B2 Methods and systems for making an optical functional film HSU ROGER WEN YI (US) 2023-01-03 US disclosed
WO-2022198024-A1 THERAPEUTIC CONJUGATES TOTUS MEDICINES INC. (US) 2022-09-22 WO disclosed
WO-2022056453-A1 THERAPEUTIC CONJUGATES TOTUS MEDICINES INC. (US) 2022-03-17 WO disclosed
WO-2022055520-A1 METHODS AND SYSTEMS FOR MAKING AN OPTICAL FUNCTIONAL FILM HSU ROGER WEN YI (US) 2022-03-17 WO disclosed