Alanine

Alanine

SCHEMBL29050844

C[C@H](N)C(=O)O.NC([C]=O)CCC(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.54
GABRD O14764 2/20 0.54
GABRA1 P14867 2/20 0.54
GABRB1 P18505 2/20 0.54
GABRG2 P18507 2/20 0.54
GABRB3 P28472 2/20 0.54
GABRA5 P31644 2/20 0.54
GABRA3 P34903 2/20 0.54
GABRA2 P47869 2/20 0.54
GABRB2 P47870 2/20 0.54
GABRA4 P48169 2/20 0.54
GABRE P78334 2/20 0.54
GABRA6 Q16445 2/20 0.54
GABRG1 Q8N1C3 2/20 0.54
GABRG3 Q99928 2/20 0.54
GABRQ Q9UN88 2/20 0.54
CYP2D6 P10635 2/20 0.53
NFKB1 P19838 2/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL756717 0.89
SCHEMBL52133 0.89
Ammonia Solution, Strong SCHEMBL28439739 0.87 CYP2D6 (0.61) GABRPGABRDGABRA1GABRB1GABRG2
Hydrochloric Acid SCHEMBL21820004 0.87 CYP2D6 (0.61) GABRPGABRDGABRA1GABRB1GABRG2
Glutamic Acid SCHEMBL7821241 0.84 GRM8 (0.72) GABRPGABRDGABRA1GABRB1GABRG2
Aspartic Acid SCHEMBL7823074 0.81 GRM8 (0.55) GABRPGABRDGABRA1GABRB1GABRG2
Succinic Acid SCHEMBL542280 0.78 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
Succinic Acid SCHEMBL542249 0.78 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
Succinic Acid SCHEMBL542250 0.78 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
D-Glutamate SCHEMBL4531315 0.77 CYP1A2 (0.82) GABRPGABRDGABRA1GABRB1GABRG2

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
CN-116322616-A Hair lightening compositions providing damage protection and sensory benefits and methods of use 欧莱雅 2023-06-23 CN disclosed