Histidine

SCHEMBL8428513

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

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARD PTGS1 PTGS2 dacA dacB dacC ftsI mrcA mrcB mrdA

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.

Compound	similarity	top predicted	shared targets
Histidine SCHEMBL8428516	0.95	GHSR (0.30)	—
Histidine SCHEMBL7757156	0.93	—	—
Histidine SCHEMBL7759763	0.92	GSR (0.32)	—
Histidine SCHEMBL6554652	0.92	—	—
Histidine SCHEMBL7757149	0.92	—	—
Histidine SCHEMBL20817128	0.88	—	—
Histidine SCHEMBL6554647	0.88	—	—
Histidine SCHEMBL28798985	0.88	GSR (0.32)	—
Histidine SCHEMBL7753923	0.87	SLC7A5 (0.30)	—
Histidine SCHEMBL27684219	0.85	SLC7A5 (0.34)	—

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0955311-A2	Peptide vaccine for canine allergy	IDEXX LABORATORIES, INC. (US)	1999-11-10	—	—	EP	claimed