SCHEMBL5597118

SCHEMBL5597118

[CH2]C(=O)[C@@H](N)Cc1c[nH]cn1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
SLC7A5 Q01650 1/20 0.33
CYP1A2 P05177 1/20 0.32

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 SCHEMBL28595604 0.85 SLC7A5 (0.45) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL2551674 0.85 SLC7A5 (0.45) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL388561 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL3258 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2
SCHEMBL358921 0.84 SCN10A (0.35) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL3259 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL995910 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL18824897 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL163443 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2
Histidine SCHEMBL8080341 0.84 SLC7A5 (0.47) CYP3A4SLC7A5CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1197222-B1 A stabilized pharmaceutical formulation comprising growth hormone and histidine NOVO NORDISK AS (DK) 2007-08-01 EP disclosed
US-6187928-B1 TREATING FUNGAL DISEASES THE ROCKEFELLER UNIVERSITY 2001-02-13 US disclosed
US-5849700-A Pharmaceutical formulation NOVO NORDISK A/S (DK) 1998-12-15 US disclosed