Acetyltryptophanamide

Acetyltryptophanamide

SCHEMBL4654401

CC(=O)NC(Cc1c[nH]c2ccccc12)C(N)=O.CCCOC(=O)C(Cc1c[nH]c2ccccc12)NC(C)=O

nearest known ligand 0.63

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 7/20 0.63
MAPT P10636 4/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
LMNA P02545 2/20 0.59
TP53 P04637 2/20 0.59
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
CYP1A2 P05177 1/20 0.59
POLB P06746 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
NFKB1 P19838 1/20 0.59
APEX1 P27695 1/20 0.59
CYP2C19 P33261 1/20 0.59
THPO P40225 1/20 0.59
BLM P54132 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
ECE1 P42892 3/20 0.57

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
SCHEMBL3193569 0.95 TACR1 (0.69) TACR1MAPTMEN1KMT2ALMNA
SCHEMBL3193567 0.95 TACR1 (0.69) TACR1MAPTMEN1KMT2ALMNA
Acetyltryptophanamide SCHEMBL3202823 0.89 ECE1 (0.68) TACR1MAPTMEN1KMT2ALMNA
Acetyltryptophanamide SCHEMBL22850012 0.89 ECE1 (0.68) TACR1MAPTMEN1KMT2ALMNA
Acetyltryptophanamide SCHEMBL455277 0.89 ECE1 (0.68) TACR1MAPTMEN1KMT2ALMNA
SCHEMBL6241872 0.86 TACR1 (0.64) TACR1MAPTMEN1KMT2ALMNA
SCHEMBL6241302 0.86 TACR1 (0.64) TACR1MAPTMEN1KMT2ALMNA
SCHEMBL6241313 0.86 TACR1 (0.64) TACR1MAPTMEN1KMT2ALMNA
SCHEMBL6238907 0.86 TACR1 (0.64) TACR1MAPTMEN1KMT2ALMNA
SCHEMBL850315 0.86 TACR1 (0.74) TACR1MAPTMEN1KMT2ALMNA

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-1428537-B1 STABILIZED PREPARATIONS CONTAINING ANTIBODY CHUGAI PHARMACEUTICAL CO LTD (JP) 2008-11-19 EP claimed