Histidine

Histidine

SCHEMBL7753919

CC(C)C[C@H](N)C(=O)O.C[C@H](N)C(=O)OC[C@H](N)C(=O)O.N[C@@H](CS)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL7753923 0.90 SLC7A5 (0.30)
Histidine SCHEMBL6554647 0.87
Histidine SCHEMBL29262331 0.86 PTGS1 (0.34)
Histidine SCHEMBL7759763 0.86 GSR (0.32)
Histidine SCHEMBL27684219 0.85 SLC7A5 (0.34)
Histidine SCHEMBL27599982 0.84 REN (0.32)
Histidine SCHEMBL7757149 0.84
Histidine SCHEMBL16444321 0.84 CYP3A4 (0.32)
Histidine SCHEMBL28633479 0.83
Histidine SCHEMBL8428516 0.83 GHSR (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082340-A1 PEPTIDE VACCINE FOR CANINE ALLERGY IDEXX LABORATORIES, INC. (US) 2001-03-14 EP claimed
WO-2000058349-A1 PEPTIDE VACCINE FOR CANINE ALLERGY IDEXX LABORATORIES, INC. (US) 2000-10-05 WO claimed