Histidine

Histidine

SCHEMBL3967555

NCC(=O)O.N[C@@H](CO)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Histidine. 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 3/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.38
PKM P14618 2/20 0.35
ALPI P09923 1/20 0.35
PTGS1 P23219 1/20 0.35
XIAP P98170 1/20 0.35
GRIA2 P42262 4/20 0.34
GRIA1 P42261 3/20 0.34
GRIA3 P42263 3/20 0.34
GRIA4 P48058 3/20 0.34
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
BLM P54132 2/20 0.33
PMP22 Q01453 2/20 0.33
KMT2A Q03164 2/20 0.33
HIF1A Q16665 2/20 0.33

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
Histidine SCHEMBL22769647 1.00 SLC7A5 (0.39) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL2976301 0.95 SLC7A5 (0.36) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL2976304 0.95 SLC7A5 (0.36) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL27673609 0.95 SLC7A5 (0.36) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL874925 0.94 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL874923 0.94 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL8027991 0.94 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL1801721 0.94 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL2763245 0.94 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL56857 0.94 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213509-A1 LIPID NANOPARTICLE NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2022-07-07 US disclosed
EP-3967649-A1 LIPID NANOPARTICLE National University Corporation Hokkaido University (JP) 2022-03-16 EP disclosed
CN-114174522-A Lipid nanoparticles 国立大学法人北海道大学 2022-03-11 CN disclosed
EP-1399221-B1 COMPOSITIONS COMPRISING OESTRONE-3-O-SULPHAMATE AND TRAIL (TNF-RELATED APOPTOSIS INDUCING LIGAND) STERIX LTD (GB) 2009-07-29 EP disclosed
US-7211246-B2 Compositions comprising oestrone-3-0-sulphamate and trail (TNF-related apoptosis inducing ligand) STERIX LIMITED (GB) 2007-05-01 US disclosed
US-20040166090-A1 Compositions comprising oestrone-3-0-sulphamate and trail (TNF-related apoptosis inducing ligand) STERIX LIMITED (GB) 2004-08-26 US disclosed
EP-1399221-A1 COMPOSITIONS COMPRISING OESTRONE-3-O-SULPHAMATE AND TRAIL (TNF-RELATED APOPTOSIS INDUCING LIGAND) Sterix Limited (GB) 2004-03-24 EP disclosed
WO-2002098511-A1 COMPOSITIONS COMPRISING OESTRONE-3-0-SULPHAMATE AND TRAIL (TNF-RELATED APOPTOSIS INDUCING LIGAND) STERIX LIMITED (GB) 2002-12-12 WO disclosed
WO-2001019373-A2 METHODS AND COMPOSITIONS FOR MODULATING RESPONSIVENESS TO CORTICOSTEROIDS BASF AKTIENGESELLSCHAFT (DE) 2001-03-22 WO disclosed
EP-0998300-A1 METHODS AND COMPOSITIONS FOR MODULATING RESPONSIVENESS TO CORTICOSTEROIDS BASF AKTIENGESELLSCHAFT (DE) 2000-05-10 EP disclosed
US-6054487-A ADMINISTERING AN INTERLEUKIN-ONE BETA CONVERTING ENZYME SUFFICIENT TO INHIBIT PRODUCTION OF GAMMA-INTERFERON BASF AKTIENGESELLSCHAFT (DE) 2000-04-25 US disclosed
WO-1998041232-A2 COMPOSITIONS FOR MODULATING RESPONSIVENESS TO CORTICOSTEROIDS BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed
EP-0308983-A2 NMR imaging with Mn(II) coordination compositions SALUTAR, INC. (US) 1989-03-29 EP 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-20040166090-A1 Compositions comprising oestrone-3-0-sulphamate and trail (TNF-related apoptosis inducing ligand) CASP3, TNFRSF1A, BAX SLC7A5 4481/4885CYP3A4 1063/4885CYP1A2 2374/4885

“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.