Histidine

Histidine

SCHEMBL29012901

N[C@@H](Cc1cnc[nH]1)C(=O)O.O=COc1nccc2ccccc12

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.55
▸ SLC7A5 Q01650 1/20 0.55
▸ NLN Q9BYT8 5/20 0.48
▸ LTA4H P09960 1/20 0.43

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
SCHEMBL4308250 0.83 NLN (0.53) CYP3A4SLC7A5NLN
Histidine SCHEMBL10008551 0.74 CYP3A4 (0.93) CYP3A4SLC7A5NLN
Histidine SCHEMBL16986405 0.74 CYP3A4 (0.93) CYP3A4SLC7A5NLN
Histidine SCHEMBL388560 0.74 CYP3A4 (1.00) CYP3A4SLC7A5
D-Histidine SCHEMBL288043 0.74 CYP3A4 (1.00) CYP3A4SLC7A5
Histidine SCHEMBL28071764 0.74 CYP3A4 (1.00) CYP3A4SLC7A5
Histidine SCHEMBL3260 0.74 CYP3A4 (1.00) CYP3A4SLC7A5
Histidine SCHEMBL137600 0.74 CYP3A4 (1.00) CYP3A4SLC7A5
Histidine SCHEMBL19974306 0.74 CYP3A4 (1.00) CYP3A4SLC7A5
Histidine SCHEMBL30852263 0.74 CYP3A4 (1.00) CYP3A4SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116789792-A Immunogenic WT-1 peptides and methods of use thereof 纪念斯隆凯特林癌症中心 2023-09-22 — — CN disclosed
CN-116327902-A Methods and compositions for treating cancer 纪念斯隆凯特林癌症中心 2023-06-27 — — CN disclosed
CN-116327903-A Methods and compositions for treating cancer 纪念斯隆凯特林癌症中心 2023-06-27 — — CN disclosed
CN-116253788-A Immunogenic WT-1 peptides and methods of use thereof 纪念斯隆凯特林癌症中心 2023-06-13 — — CN disclosed
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