Leucine

Leucine

SCHEMBL348968

CC(C)C[C@H](N)C(=O)O.NCC(=O)O.N[C@@H](CO)C(=O)O

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Leucine. 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
SLC7A5 Q01650 1/20 0.69
SLC1A3 P43003 6/20 0.55
SLC1A2 P43004 6/20 0.55
SLC1A1 P43005 6/20 0.48
CACNA2D1 P54289 2/20 0.41
CACNB3 P54284 1/20 0.41
CACNA1C Q13936 1/20 0.41
PGR P06401 1/20 0.41
ADRA1A P35348 1/20 0.41
HTR2B P41595 1/20 0.41
CACNA2D2 Q9NY47 1/20 0.41
GRIK1 P39086 4/20 0.40
GRIK2 Q13002 2/20 0.40
GLRA1 P23415 1/20 0.39
SLC6A9 P48067 1/20 0.39
OR51E2 Q9H255 1/20 0.39
GRIA2 P42262 2/20 0.38
GRIA4 P48058 2/20 0.38
GRIK3 Q13003 2/20 0.38
GRIK5 Q16478 2/20 0.38

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
Leucine SCHEMBL27569034 1.00 SLC7A5 (0.69) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1
Leucine SCHEMBL6129074 0.96 SLC7A5 (0.64) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1
Leucine SCHEMBL5520318 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
D-Leucine SCHEMBL1537345 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1
D-Leucine SCHEMBL18114536 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1
Leucine SCHEMBL4011464 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Leucine SCHEMBL5520323 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Leucine SCHEMBL625031 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1
Leucine SCHEMBL2154089 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1
Leucine SCHEMBL4639771 0.92 SLC7A5 (0.82) SLC7A5SLC1A3SLC1A2SLC1A1CACNA2D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1601330-A4 ANTITUMOR AGENTS COMPRISING A TARGETING PORTION AND AN IMMUNE RESPONSE TRIGGERING PORTION GHC RES DEV CORP (US) 2008-05-07 EP claimed
CN-1787838-A Antitumor agent comprising targeting moiety and immune response triggering moiety GREENVILLE HOSPITAL SYSTEM (US) 2006-06-14 CN claimed
EP-1601330-A2 ANTITUMOR AGENTS COMPRISING A TARGETING PORTION AND AN IMMUNE RESPONSE TRIGGERING PORTION Greenville Hospital System (US) 2005-12-07 EP claimed
US-20050164182-A1 Nucleoside comprising reporter molecule cleavable by hydrolase such as esterases, phosphatases, peptidases, penicillin amidases, glycosidases, and phosphorylases; limits polymerase activity; sequencing; solid phase synthesis GE HEALTHCARE UK LIMITED (GB) 2005-07-28 US claimed
JP-2005517646-A 2005-06-16 JP claimed
US-20050025771-A1 Antitumor agents comprising a targeting portion and an immune response triggering portion GREENVILLE HOSPITAL SYSTEM 2005-02-03 US claimed
WO-2004078137-A2 ANTITUMOR AGENTS COMPRISING A TARGETING PORTION AND AN IMMUNE RESPONSE TRIGGERING PORTION GREENVILLE HOSPITAL SYSTEM (US) 2004-09-16 WO claimed
EP-1451201-A2 NUCLEOTIDE ANALOGUES AND THEIR USE FOR NUCLEIC ACID SEQUENCING Amersham Biosciences UK Limited (GB) 2004-09-01 EP claimed
WO-2003048178-A2 NUCLEOTIDE ANALOGUES AND THEIR USE FOR NUCLEIC ACID SEQUENCING AMERSHAM BIOSCIENCES UK LIMITED (GB) 2003-06-12 WO claimed
US-20240124892-A1 ADENO-ASSOCIATED VIRUSES AND METHODS AND MATERIALS FOR MAKING AND USING ADENO-ASSOCIATED VIRUSES UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2024-04-18 US disclosed
US-20230165952-A1 BETACORONAVIRUS PROPHYLAXIS AND THERAPY Nykode Therapeutics ASA (NO) 2023-06-01 US disclosed
EP-4143210-A1 BETACORONAVIRUS PROPHYLAXIS AND THERAPY Nykode Therapeutics ASA (NO) 2023-03-08 EP disclosed
US-20220348613-A1 ADENO-ASSOCIATED VIRUSES AND METHODS AND MATERIALS FOR MAKING AND USING ADENO-ASSOCIATED VIRUSES UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2022-11-03 US disclosed
WO-2021219897-A1 BETACORONAVIRUS PROPHYLAXIS AND THERAPY VACCIBODY AS (NO) 2021-11-04 WO disclosed
US-6180084-B1 CONTACTING PURIFIED NGR RECEPTOR WITH ONE OR MORE MOLECULES AND DETERMINING SPECIFIC BINDING OF MOLECULE TO NGR RECEPTOR, WHERE PRESENCE OF SPECIFIC BINDING IDENTIFIES MOLECULE AS TUMOR HOMING MOLECULE THAT HOMES TO ANGIOGENIC VASCULATURE THE BURNHAM INSTITUTE 2001-01-30 US disclosed
WO-2000042973-A2 HOMING PRO-APOPTOTIC CONJUGATES AND METHODS OF USING SAME THE BURNHAM INSTITUTE (US) 2000-07-27 WO disclosed
EP-1015884-A1 METHODS OF IDENTIFYING MOLECULES THAT HOME TO ANGIOGENIC VASCULATURE IN TUMORS The Burnham Institute (US) 2000-07-05 EP disclosed
EP-0927045-A2 TUMOR HOMING MOLECULES, CONJUGATES DERIVED THEREFROM, AND METHODS OF USING SAME The Burnham Institute (US) 1999-07-07 EP disclosed
WO-1999013329-A1 METHODS OF IDENTIFYING MOLECULES THAT HOME TO ANGIOGENIC VASCULATURE IN TUMORS THE BURNHAM INSTITUTE (US) 1999-03-18 WO disclosed
WO-1998010795-A2 TUMOR HOMING MOLECULES, CONJUGATES DERIVED THEREFROM, AND METHODS OF USING SAME THE BURNHAM INSTITUTE (US) 1998-03-19 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 (1 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-20050164182-A1 Nucleoside comprising reporter molecule cleavable by hydrolase such as esterases, phosphatases, peptidases, penicillin amidases, glycosidases, and phosphorylases; limits polymerase activity; sequencing; solid phase synthesis PNP, PEPD, DNPEP SLC7A5 2009/4885SLC1A3 2903/4885SLC1A2 3422/4885

“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.