Phenanthroline

Phenanthroline

SCHEMBL28825890

NC(=O)c1ccc(Cl)cc1.NC(N)=S.c1cnc2c(c1)ccc1cccnc12

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 5/20 0.54
GAA P10253 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
KDR P35968 1/20 0.53
PARP1 P09874 1/20 0.50
SLC40A1 Q9NP59 1/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP3A4 P08684 2/20 0.47
HSP90AA1 P07900 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GMNN O75496 1/20 0.47
TP53 P04637 1/20 0.47
MMP2 P08253 1/20 0.47
CYP2D6 P10635 1/20 0.47
MAPT P10636 1/20 0.47
MMP9 P14780 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47

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
Thiourea SCHEMBL28825892 0.88 LMNA (0.56) MAP4K4GAAL3MBTL1KDRPARP1
8-Aminoquinoline SCHEMBL28695606 0.84 L3MBTL1 (0.56) MAP4K4GAAL3MBTL1KDRPARP1
SCHEMBL6070469 0.76 MKNK2 (0.65) MAP4K4PARP1SLC40A1LMNASMN1; SMN2
SCHEMBL9755467 0.74 L3MBTL1 (0.69) GAAL3MBTL1KDRSMN1; SMN2TP53
SCHEMBL21358860 0.74 PSMD14 (0.61) MAP4K4PARP1SLC40A1LMNASMN1; SMN2
SCHEMBL77931 0.73 MAP4K4 (0.62) MAP4K4L3MBTL1PARP1LMNASMN1; SMN2
SCHEMBL29959902 0.73 MAP4K4 (0.62) MAP4K4L3MBTL1PARP1LMNASMN1; SMN2
SCHEMBL12548430 0.71 PIM1 (0.62) L3MBTL1PARP1SLC40A1LMNASMN1; SMN2
Phenanthroline SCHEMBL9806287 0.71 CCR1 (0.84) L3MBTL1PARP1LMNASMN1; SMN2CYP3A4
Hydrochloric Acid SCHEMBL3772040 0.71 MAP4K4 (0.60) MAP4K4L3MBTL1PARP1LMNACYP3A4

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-105399740-A Acridine derivative, preparation method thereof and application of same serving as anti-tumor drug UNIV GUANGXI CHINESE MEDICINE 2016-03-16 CN disclosed