Terpyridine

Terpyridine

SCHEMBL7790809

O=[N+]([O-])O.[Pt+2].[S-]c1ccncc1.[S-]c1ccncc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERG11

The experimentally established mechanism targets of Terpyridine. 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
KDM4E B2RXH2 6/20 0.53
LMNA P02545 5/20 0.53
CCR1 P32246 3/20 0.53
CCR5 P51681 3/20 0.53
CCR8 P51685 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
TP53 P04637 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
ALOX15 P16050 2/20 0.53
HTT P42858 2/20 0.53
ALPL P05186 1/20 0.53
HSP90AA1 P07900 1/20 0.53
ALPI P09923 1/20 0.53
ALPG P10696 1/20 0.53
MAPK1 P28482 1/20 0.53
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
PRKCA P17252 1/20 0.41
P4HTM Q9NXG6 2/20 0.41

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
4-Mercaptopyridine SCHEMBL7785225 0.89 CCR1 (0.47) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL7793859 0.82 KDM4E (0.72) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL31707325 0.80 KDM4E (0.64) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL30883364 0.78 KDM4E (0.55) KDM4ELMNACCR1CCR5CCR8
4-Mercaptopyridine SCHEMBL7790757 0.77 CCR1 (0.55) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL29085081 0.75 KDM4E (0.67) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL29941316 0.75 KDM4E (0.95) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL2406854 0.73 KDM4E (0.82) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL5396565 0.73 KDM4E (0.90) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL30610403 0.73 KDM4E (0.90) KDM4ELMNACCR1CCR5CCR8

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-1155025-A1 PLATINUM (II) COMPOUNDS ISIS INNOVATION LIMITED (GB) 2001-11-21 EP disclosed
WO-2000050431-A1 PLATINUM (II) COMPOUNDS ISIS INNOVATION LIMITED (GB) 2000-08-31 WO disclosed