Histidine

Histidine

SCHEMBL9719668

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

nearest known ligand 0.35

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.34
CYP3A4 P08684 1/20 0.34
CTSC P53634 2/20 0.33
CYP1A2 P05177 1/20 0.33
GLI1 P08151 1/20 0.33
DPP4 P27487 2/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
NOS2 P35228 2/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
ELANE P08246 1/20 0.30
TPH1 P17752 1/20 0.30
ALPI P09923 1/20 0.30
PKM P14618 1/20 0.30
PTGS1 P23219 1/20 0.30
XIAP P98170 1/20 0.30

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 SCHEMBL10455821 1.00 SLC7A5 (0.34) SLC7A5CYP3A4CTSCCYP1A2GLI1
Histidine SCHEMBL27902238 0.92 SLC7A5 (0.35) SLC7A5CYP3A4CTSCCYP1A2HTR2C
Histidine SCHEMBL2586200 0.92 SLC7A5 (0.35) SLC7A5CYP3A4CTSCCYP1A2HTR2C
Histidine SCHEMBL2586203 0.92 SLC7A5 (0.35) SLC7A5CYP3A4CTSCCYP1A2HTR2C
D-Histidine SCHEMBL11606906 0.92 SLC7A5 (0.35) SLC7A5CYP3A4CTSCCYP1A2HTR2C
Histidine SCHEMBL6903283 0.89 TRHR (0.34)
Histidine SCHEMBL5583260 0.88 CYP3A4 (0.31) SLC7A5CYP3A4CTSCCYP1A2
Histidine SCHEMBL3088582 0.88 CYP3A4 (0.32) SLC7A5CYP3A4CTSCCYP1A2
Histidine SCHEMBL3490081 0.88 CYP3A4 (0.32) SLC7A5CYP3A4CTSCCYP1A2
Histidine SCHEMBL790243 0.88 CYP3A4 (0.32) SLC7A5CYP3A4CTSCCYP1A2

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-0373904-A1 Process and composition for increasing brain dopamine release MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1990-06-20 EP claimed
US-5118670-A PROCESS AND COMPOSITION FOR INCREASING BRAIN DOPAMINE RELEASE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1992-06-02 US disclosed