Pyridine

Pyridine

SCHEMBL7510140

Br.Oc1cccc2c1c1cccc(Cl)c1n2Cc1ccccc1.c1ccncc1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Pyridine. 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
PLA2G2A P14555 2/20 0.41
ESR1 P03372 1/20 0.41
MAPT P10636 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MCL1 Q07820 1/20 0.40
HIF1A Q16665 1/20 0.40
CYP19A1 P11511 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRA5 P31644 1/20 0.39
SRC P12931 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
MAPK1 P28482 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6926546 0.91 CYP19A1 (0.47) PLA2G2AESR1MAPTMEN1KMT2A
SCHEMBL6924605 0.80 MEN1 (0.43) PLA2G2AMAPTMEN1KMT2AALDH1A1
Pyridine SCHEMBL7506032 0.80 SRC (0.44) PLA2G2AMAPTMEN1KMT2AKDM4E
SCHEMBL6924122 0.77 PLA2G2A (0.46) PLA2G2AMAPTMEN1KMT2AKDM4E
SCHEMBL6927392 0.77 ATM (0.53) PLA2G2AMAPTMEN1KMT2AKDM4E
SCHEMBL6921173 0.76 CYP19A1 (0.65) PLA2G2AMAPTMEN1KMT2AKDM4E
SCHEMBL6924327 0.69 SRC (0.51) PLA2G2AMAPTMEN1KMT2AKDM4E
SCHEMBL6921052 0.69 MEN1 (0.43) PLA2G2AMAPTMEN1KMT2AALDH1A1
Bromide SCHEMBL7510146 0.68 ESR1 (0.38) ESR1MAPTMEN1KMT2AKDM4E
SCHEMBL7723992 0.68 SRC (0.53) PLA2G2AMAPTMEN1KMT2AKDM4E

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-1210329-A2 AMINOALKOXY CARBAZOLES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2002-06-05 EP disclosed
WO-2001017963-A2 AMINOALKOXY CARBAZOLES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2001-03-15 WO disclosed