Alanine

Alanine

SCHEMBL7616260

C[C@H](N)C(=O)[O-].C[C@H](N)C(=O)[O-].C[C@H](N)C(=O)[O-].[Bi+3]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HRH2

The experimentally established mechanism targets of Alanine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.38
CA1 P00915 5/20 0.38
CA2 P00918 1/20 0.36
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
NFKB1 P19838 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
DPP4 P27487 1/20 0.35
GABRP O00591 3/20 0.33
GABRD O14764 3/20 0.33
GABRA1 P14867 3/20 0.33
GABRB1 P18505 3/20 0.33
GABRG2 P18507 3/20 0.33
GABRB3 P28472 3/20 0.33
GABRA5 P31644 3/20 0.33
GABRA3 P34903 3/20 0.33
GABRA2 P47869 3/20 0.33
GABRB2 P47870 3/20 0.33
GABRA4 P48169 3/20 0.33
GABRE P78334 3/20 0.33

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
Alanine SCHEMBL1436676 0.93
Alanine SCHEMBL10814860 0.93 SLC7A5 (0.38) SLC7A5CA1CA2CYP3A4TSHR
Alanine SCHEMBL5943276 0.93 SLC7A5 (0.38) SLC7A5CA1CA2CYP3A4TSHR
Alanine SCHEMBL19326825 0.93 SLC7A5 (0.38) SLC7A5CA1CA2CYP3A4TSHR
Alanine SCHEMBL497114 0.93 SLC7A5 (0.38) SLC7A5CA1CA2CYP3A4TSHR
Alanine SCHEMBL7614895 0.93 SLC7A5 (0.38) SLC7A5CA1CA2CYP3A4TSHR
Alanine SCHEMBL735033 0.93
Alanine SCHEMBL7532124 0.93 CA1 (0.44) SLC7A5CA1CA2CYP3A4TSHR
Alanine SCHEMBL4669777 0.93
Alanine SCHEMBL15111230 0.93 SLC7A5 (0.38) SLC7A5CA1CA2CYP3A4TSHR

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927232-B1 ELECTRODEPOSITABLE COATING COMPOSITION CONTAINING BISMUTH AND AMINO ACID MATERIALS AND ELECTRODEPOSITION METHOD PPG IND OHIO INC (US) 2002-01-16 EP disclosed