Histidine

Histidine

SCHEMBL2763245

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

nearest known ligand 0.43

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 0.43
CYP3A4 P08684 2/20 0.43
CYP1A2 P05177 1/20 0.42
PKM P14618 2/20 0.39
ALPI P09923 1/20 0.39
PTGS1 P23219 1/20 0.39
XIAP P98170 1/20 0.39
GRIA2 P42262 5/20 0.37
GRIA1 P42261 4/20 0.37
GRIA3 P42263 4/20 0.37
GRIA4 P48058 4/20 0.37
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
BLM P54132 2/20 0.36
PMP22 Q01453 2/20 0.36
KMT2A Q03164 2/20 0.36
HIF1A Q16665 2/20 0.36

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 SCHEMBL8027991 1.00 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL892614 1.00 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL56857 1.00 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL1801721 1.00 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL1136528 1.00 SLC7A5 (0.43) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL27672961 0.98 SLC7A5 (0.42) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL29250210 0.97 SLC7A5 (0.41) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL22769647 0.94 SLC7A5 (0.39) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL20678156 0.94 SLC7A5 (0.39) SLC7A5CYP3A4CYP1A2PKMALPI
Histidine SCHEMBL3967555 0.94 SLC7A5 (0.39) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150110755-A1 ELASTIN PRODUCING FIBROBLAST FORMULATIONS AND METHODS OF USING THE SAME NULASTIN, INC. 2015-04-23 US disclosed
US-7666829-B2 contains manganese chloride, manganese sulfate or manganese nitrate and ferric ammonium citrate or ferric chloride, for treating skin disorders; stimulating production of insoluble elastin, or deposition of collagen, fibroblasts; improve the appearance of scar; wrinkle resistance HUMAN MATRIX SCIENCES, LLC (US) 2010-02-23 US disclosed
EP-1631597-A4 DISPLACEABLE LINKER SOLID PHASE CHEMICAL LIGATION GRYPHON THERAPEUTICS INC (US) 2007-07-11 EP disclosed
EP-1631597-A2 DISPLACEABLE LINKER SOLID PHASE CHEMICAL LIGATION Gryphon Therapeutics, Inc. (US) 2006-03-08 EP disclosed
WO-2004105685-A2 DISPLACEABLE LINKER SOLID PHASE CHEMICAL LIGATION GRYPHON THERAPEUTICS, INC. (US) 2004-12-09 WO disclosed