Tryptophan Methyl Ester

Tryptophan Methyl Ester

SCHEMBL475266

COC(=O)[C@H](N)Cc1c[nH]c2ccccc12.Cl

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Tryptophan Methyl Ester. 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
TACR1 known ✓ P25103 2/20 0.65
HTR2A known ✓ P28223 2/20 0.58
ADRB1 known ✓ P08588 1/20 0.58
HTR1A known ✓ P08908 1/20 0.58
ADRA2A known ✓ P08913 1/20 0.58
SLC6A2 known ✓ P23975 1/20 0.58
HTR1D known ✓ P28221 1/20 0.58
HTR1B known ✓ P28222 1/20 0.58
HTR2C known ✓ P28335 1/20 0.58
HTR1E known ✓ P28566 1/20 0.58
SLC6A4 known ✓ P31645 1/20 0.58
HTR7 known ✓ P34969 1/20 0.58
HTR2B known ✓ P41595 1/20 0.58
HTR6 known ✓ P50406 1/20 0.58
SLC6A3 known ✓ Q01959 1/20 0.58
HCRTR1 known ✓ O43613 1/20 0.58
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
KDM4E B2RXH2 2/20 0.68
MAPT P10636 2/20 0.68

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
Tryptophan Methyl Ester SCHEMBL29398306 1.00 MEN1 (0.68) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL378072 1.00 MEN1 (0.68) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL29401004 1.00 MEN1 (0.68) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL378071 1.00 MEN1 (0.68) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL31291573 0.99 MEN1 (0.67) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL1195735 0.99 MEN1 (0.70) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL19161138 0.99 MEN1 (0.70) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL475267 0.99 MEN1 (0.70) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL122907 0.99 MEN1 (0.70) MEN1KMT2AKDM4EMAPTLMNA
Tryptophan Methyl Ester SCHEMBL30180690 0.99 MEN1 (0.70) MEN1KMT2AKDM4EMAPTLMNA

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 350 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119569745-A Spiroindole alkaloid in Polygonum tinctorium, and preparation method and application thereof 沈阳药科大学 2025-03-07 CN claimed
CN-114839308-B Method for detecting L-tryptophan methyl ester hydrochloride in D-tryptophan methyl ester hydrochloride 江苏天士力帝益药业有限公司 2024-12-03 CN claimed
CN-118666841-A Indole-tetramic acid compound, preparation and medical application thereof 中国医学科学院药物研究所 2024-09-20 CN claimed
CN-117843638-A Preparation and application of bifunctional molecular compound based on RSL3 induced GPX4 protein degradation 沈阳药科大学 2024-04-09 CN claimed
CN-115232130-B APN and AKT double-target inhibitor and preparation method and application thereof 山东大学 2024-01-12 CN claimed
CN-116574102-A Preparation method of tadalafil 广东九明制药有限公司 2023-08-11 CN claimed
CN-113527399-B Ginsenoside CK derivative and application thereof in preparation of antitumor drugs 陕西巨子生物技术有限公司 2023-01-31 CN claimed
CN-113999228-B Synthesis method of tadalafil 南京卓康医药科技有限公司 2022-11-04 CN claimed
CN-115232130-A APN and AKT double-target-point inhibitor and preparation method and application thereof 山东大学 2022-10-25 CN claimed
CN-114839308-A Method for detecting L-tryptophan methyl ester hydrochloride in D-tryptophan methyl ester hydrochloride 江苏天士力帝益药业有限公司 2022-08-02 CN claimed
US-7550479-B2 Modified Pictet-Spengler reaction and products prepared therefrom LILLY ICOS LLC (US) 2009-06-23 US claimed
EP-1546149-B1 MODIFIED PICTET-SPENGLER REACTION AND PRODUCTS PREPARED THEREFROM LILLY ICOS LLC (US) 2008-11-26 EP claimed
CN-100430395-C Improved pictet-spengler reaction and products produced therefrom LILLY ICOS LLC (US) 2008-11-05 CN claimed
US-7223863-B2 Process for preparing Tadalafil and its intermediate ALEMBIC LIMITED (IN) 2007-05-29 US claimed
WO-2007052283-A1 AN IMPROVED PROCESS FOR PREPARING TADALAFIL AND ITS INTERMEDIATE ALEMBIC LIMITED (IN) 2007-05-10 WO claimed
US-20060258865-A1 Process for preparing Tadalafil and its intermediate ALEMBIC LIMITED (IN) 2006-11-16 US claimed
US-20060004203-A1 Modified pictet-spengler reaction and products prepared therefrom ICOS CORPORATION 2006-01-05 US claimed
CN-1671706-A Modified pictet-spengler reaction and products prepared therefrom LILLY ICOS LLC (US) 2005-09-21 CN claimed
EP-1546149-A1 MODIFIED PICTET-SPENGLER REACTION AND PRODUCTS PREPARED THEREFROM Lilly Icos LLC (US) 2005-06-29 EP claimed
WO-2004011463-A1 MODIFIED PICTET-SPENGLER REACTION AND PRODUCTS PREPARED THEREFROM LILLY ICOS, LLC. (US) 2004-02-05 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060004203-A1 Modified pictet-spengler reaction and products prepared therefrom WEE2, WEE1, WASF2 TACR1 1540/4885HTR2A 818/4885ADRB1 1993/4885
US-20060258865-A1 Process for preparing Tadalafil and its intermediate PDE3B, PDE5A, PDE3A TACR1 556/4885HTR2A 1073/4885ADRB1 22/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.