Emidurdar

Emidurdar

SCHEMBL30845296

O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(Br)cc1-c1nnn[nH]1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 1/20 0.54
GRIK1 P39086 1/20 0.47
TMPRSS4 Q9NRS4 1/20 0.44
GPR35 Q9HC97 2/20 0.42
TRPV1 Q8NER1 1/20 0.41
MAPT P10636 1/20 0.40
KDR P35968 6/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RAF1 P04049 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 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
Emidurdar SCHEMBL1463101 1.00 KCNMA1 (0.54) KCNMA1GRIK1TMPRSS4GPR35TRPV1
SCHEMBL4718263 0.92 GPR35 (0.47) KCNMA1GRIK1GPR35TRPV1MAPT
SCHEMBL1462393 0.91 GRIK1 (0.60) KCNMA1GRIK1GPR35TRPV1MAPT
SCHEMBL2834395 0.88 KCNMA1 (0.69) KCNMA1TMPRSS4GPR35MAPTKDR
SCHEMBL1463472 0.87 GRIK1 (0.47) KCNMA1GRIK1TMPRSS4TRPV1MAPT
SCHEMBL3579491 0.86 PSEN1 (0.47) KCNMA1TRPV1MAPTKDRCA12
SCHEMBL1463507 0.85 KMT2A (0.45) GRIK1MAPTCA12CA1CA2
SCHEMBL3580763 0.85 PSEN1 (0.45) KCNMA1GRIK1TMPRSS4TRPV1MAPT
SCHEMBL1463403 0.84 KDR (0.45) GRIK1MAPTKDRCA12CA1
SCHEMBL3574142 0.84 PSEN1 (0.44) KCNMA1GRIK1TMPRSS4TRPV1KDR

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-117916224-A Thermodynamically stable form of SCO-101 思坎迪昂肿瘤学股份有限公司 2024-04-19 CN disclosed