SCHEMBL14214622

SCHEMBL14214622

COc1ccc(Nc2ncnc(-n3c(=O)[nH]c4ccccc43)n2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.43
KDR P35968 2/20 0.43
MAPK14 Q16539 2/20 0.43
VCP P55072 1/20 0.42
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40
GABRA6 Q16445 2/20 0.40
GABRG1 Q8N1C3 2/20 0.40
GABRG3 Q99928 2/20 0.40
GABRQ Q9UN88 2/20 0.40

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
SCHEMBL14214630 0.85 LCK (0.51) LCKKDRMAPK14VCPGABRP
SCHEMBL14214540 0.81 GSK3B (0.43) LCKKDRMAPK14GABRPGABRD
SCHEMBL14214546 0.81 PIK3CA (0.48) LCKKDRMAPK14GABRPGABRD
SCHEMBL14214545 0.78 AURKA (0.47) LCKKDRMAPK14GABRPGABRD
SCHEMBL14214629 0.78 GABRP (0.46) LCKKDRMAPK14VCPGABRP
SCHEMBL14214543 0.78 CCNT1 (0.46) GSK3BAURKACCNT1CDK1CCNB1
SCHEMBL14214608 0.77 GSK3B (0.41) LCKKDRMAPK14GABRPGABRD
SCHEMBL14214544 0.76 PIK3CA (0.46) LCKKDRMAPK14EGFRAURKA
SCHEMBL14214537 0.76 PIK3CA (0.61) LCKKDRMAPK14EGFRAURKA
SCHEMBL14214536 0.76 MAPK1 (0.50) KDRGABRPGABRDGABRA1GABRB1

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
EP-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed