Histidine

Histidine

SCHEMBL5221755

NC(=O)O.NC(Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
SLC7A5 Q01650 3/20 0.45
CYP3A4 P08684 2/20 0.45
PKM P14618 2/20 0.41
ALPI P09923 1/20 0.41
PTGS1 P23219 1/20 0.41
XIAP P98170 1/20 0.41
GRIA2 P42262 4/20 0.39
GRIA1 P42261 3/20 0.39
GRIA3 P42263 3/20 0.39
GRIA4 P48058 3/20 0.39
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
BLM P54132 2/20 0.38
PMP22 Q01453 2/20 0.38
KMT2A Q03164 2/20 0.38
HIF1A Q16665 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
Histidine SCHEMBL5221758 1.00 CYP1A2 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL18824897 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL3258 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL388561 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL388563 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL3259 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL995910 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL163442 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL163443 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI
Histidine SCHEMBL8080341 0.97 SLC7A5 (0.47) CYP1A2SLC7A5CYP3A4PKMALPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200095275-A1 SITE-SELECTIVE FUNCTIONALIZATION OF PROTEINS USING TRACELESS AFFINITY LABELS KRANTZ ALEXANDER (US) 2020-03-26 US disclosed
US-10329321-B2 Site-selective functionalization of proteins using traceless affinity labels Krantz, Alexander (US) 2019-06-25 US disclosed
EP-3413921-A1 SITE-SELECTIVE FUNCTIONALIZATION OF PROTEINS USING TRACELESS AFFINITY LABLES Krantz, Alexander (US) 2018-12-19 EP disclosed
US-20170275331-A1 SITE-SELECTIVE FUNCTIONALIZATION OF PROTEINS USING TRACELESS AFFINITY LABELS KRANTZ ALEXANDER (US) 2017-09-28 US disclosed
WO-2017139329-A1 SITE-SELECTIVE FUNCTIONALIZATION OF PROTEINS USING TRACELESS AFFINITY LABLES KRANTZ ALEXANDER (US) 2017-08-17 WO disclosed
EP-1575900-A4 N-METHYL AMINO ACIDS UBIQUITOUS TECHNOLOGIES PTY LT (AU) 2007-02-21 EP disclosed
US-20050245432-A1 N-methyl amino acids UBIQUITOUS TECHNOLOGIES PTY. LTD. (AU) 2005-11-03 US disclosed
EP-1575900-A1 N-METHYL AMINO ACIDS UBIQUITOUS TECHNOLOGIES PTY LTD (AU) 2005-09-21 EP disclosed
WO-2004007427-A1 N-METHYL AMINO ACIDS UBIQUITOUS TECHNOLOGIES PTY LTD (AU) 2004-01-22 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 (4 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-20200095275-A1 SITE-SELECTIVE FUNCTIONALIZATION OF PROTEINS USING TRACELESS AFFINITY LABELS MYCBP, FABP3, STUB1 CYP1A2 3054/4885SLC7A5 955/4885CYP3A4 3090/4885
US-20050245432-A1 N-methyl amino acids VIP, NPPA, PTMS CYP1A2 4842/4885SLC7A5 101/4885CYP3A4 4773/4885
US-20170275331-A1 SITE-SELECTIVE FUNCTIONALIZATION OF PROTEINS USING TRACELESS AFFINITY LABELS MYCBP, FABP3, STUB1 CYP1A2 3054/4885SLC7A5 955/4885CYP3A4 3090/4885
US-10329321-B2 Site-selective functionalization of proteins using traceless affinity labels MYCBP, FABP3, STUB1 CYP1A2 3054/4885SLC7A5 955/4885CYP3A4 3090/4885

“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.