Tryptophan

Tryptophan

SCHEMBL7056086

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

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Tryptophan. 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
ADORA3 known ✓ P0DMS8 1/20 0.61
KDM4E B2RXH2 3/20 0.89
MAPT P10636 3/20 0.89
KMT2A Q03164 3/20 0.89
LMNA P02545 2/20 0.89
TSHR P16473 2/20 0.89
BLM P54132 2/20 0.89
PMP22 Q01453 2/20 0.89
MEN1 O00255 2/20 0.89
MPO P05164 1/20 0.89
HIF1A Q16665 1/20 0.89
SMN1; SMN2 Q16637 1/20 0.63
APAF1 O14727 1/20 0.62
POLB P06746 1/20 0.62
RECQL P46063 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
HTR2A P28223 3/20 0.61
HTR1A P08908 2/20 0.61
HTR2C P28335 2/20 0.61
SLC6A4 P31645 2/20 0.61

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 SCHEMBL1675340 1.00 KDM4E (0.89) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL424582 1.00 KDM4E (0.89) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL27137714 1.00 KDM4E (0.89) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL7056081 1.00 KDM4E (0.89) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL424583 1.00 KDM4E (0.89) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL6046200 0.95 KMT2A (0.80) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL4287329 0.95 KDM4E (0.80) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL6033338 0.95 KDM4E (0.80) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL7103661 0.95 KDM4E (0.80) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL23141133 0.94 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10065989-B2 Molecular sleds and uses thereof The Broad Institute Inc. (US) 2018-09-04 US disclosed
US-20150210738-A1 MOLECULAR SLEDS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-30 US disclosed
WO-2014012090-A1 MOLECULAR SLEDS COMPRISING A POSITIVELY-CHARGED AMINO ACID SEQUENCE AND A MOLECULAR CARGO AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2014-01-16 WO disclosed
EP-1305338-A2 MODIFIED PEPTIDES WITH INCREASED POTENCY THERATECHNOLOGIES INC. (CA) 2003-05-02 EP disclosed
WO-2002010195-A2 MODIFIED PEPTIDES WITH INCREASED POTENCY THERATECHNOLOGIES INC. (CA) 2002-02-07 WO disclosed
EP-0538366-A4 1994-04-20 EP disclosed
EP-0538366-A1 RETROVIRAL PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-04-28 EP disclosed
WO-1993002674-A1 HIV PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-02-18 WO disclosed
WO-1992013552-A1 ANTI-AGGREGATORY PEPTIDES CONTAINING AN AROMATIC ESTER OR AMIDE SMITHKLINE BEECHAM CORPORATION (US) 1992-08-20 WO disclosed
WO-1992009297-A1 HIV PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1992-06-11 WO disclosed
WO-1992007568-A1 η-TURN PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1992-05-14 WO disclosed
WO-1992000750-A1 RETROVIRAL PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1992-01-23 WO disclosed
WO-1992000948-A1 INHIBITORS OF RETROVIRAL PROTEASES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-23 WO disclosed
WO-1991007429-A1 ANTI-AGGREGATORY PEPTIDES CONTAINING A MERCAPTAN OR SULFIDE MOIETY SMITHKLINE BEECHAM CORPORATION (US) 1991-05-30 WO disclosed

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-20150210738-A1 MOLECULAR SLEDS AND USES THEREOF SSB, DDHD2, CD44 ADORA3 3985/4885KDM4E 3944/4885MAPT 1079/4885
US-10065989-B2 Molecular sleds and uses thereof SSB, DDHD2, CD44 ADORA3 4031/4885KDM4E 4053/4885MAPT 995/4885

“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.