SCHEMBL3840922 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NR1H2	P55055	10/20	0.35

▸	PARP1	P09874	1/20	0.35

▸	NR1H3	Q13133	3/20	0.34

▸	ALDH1A1	P00352	1/20	0.34

▸	BRD4	O60885	1/20	0.33

▸	CREBBP	Q92793	1/20	0.33

▸	TBK1	Q9UHD2	3/20	0.33

▸	ATR	Q13535	1/20	0.32

▸	ATRIP	Q8WXE1	1/20	0.32

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.

Compound	similarity	top predicted	shared targets
SCHEMBL3835632	0.91	PARP1 (0.40)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3835025	0.91	PARP1 (0.40)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3839027	0.90	PARP1 (0.37)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3835267	0.90	NR1H2 (0.37)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3836969	0.89	CDK2 (0.35)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3835247	0.89	PARP1 (0.37)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3839452	0.89	PARP1 (0.38)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3841029	0.89	NR1H2 (0.38)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3837647	0.89	NR1H2 (0.36)	NR1H2PARP1NR1H3BRD4CREBBP
SCHEMBL3835120	0.89	NR1H2 (0.39)	NR1H2PARP1NR1H3BRD4CREBBP

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2108642-A1	JAK INHIBITOR	Kyowa Hakko Kirin Co., Ltd. (JP)	2009-10-14	—	—	EP	disclosed