Diphenylacetylene

Diphenylacetylene

SCHEMBL23754281

C(#Cc1ccccc1)c1ccccc1.CSC

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.75
MAPT P10636 2/20 0.55
KCNH2 Q12809 1/20 0.52
GRM5 P41594 6/20 0.52
NPC1 O15118 4/20 0.52
CYP1A2 P05177 4/20 0.52
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
CYP3A4 P08684 3/20 0.52
CYP2C9 P11712 3/20 0.52
CYP2C19 P33261 3/20 0.52
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
KMT2A Q03164 2/20 0.52
THPO P40225 2/20 0.52
TP53 P04637 1/20 0.52
CYP2D6 P10635 1/20 0.52
PKM P14618 1/20 0.52

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
Diphenylacetylene SCHEMBL68254 0.87 APP (1.00) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL960609 0.87 APP (1.00) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL29188592 0.87 APP (1.00) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL27449385 0.84 APP (0.80) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL23754283 0.84 APP (0.80) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL9273707 0.83 APP (0.92) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL5576302 0.83 APP (0.92) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL23754282 0.83 APP (0.92) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL31286315 0.83 APP (0.92) APPMAPTKCNH2GRM5NPC1
Diphenylacetylene SCHEMBL28966277 0.83 APP (0.92) APPMAPTKCNH2GRM5NPC1

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
WO-2021160874-A1 METHOD FOR PREPARING A COMPOSITE MATERIAL WITH CORE-SHELL NANOPARTICLES THE SHELL OF WHICH IS MADE FROM GRAPHENE INSTITUT MINES TELECOM (FR) 2021-08-19 WO claimed
WO-2021160874-A1 METHOD FOR PREPARING A COMPOSITE MATERIAL WITH CORE-SHELL NANOPARTICLES THE SHELL OF WHICH IS MADE FROM GRAPHENE INSTITUT MINES TELECOM (FR) 2021-08-19 WO disclosed