SCHEMBL28926554

SCHEMBL28926554

O=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O[C@]1(O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O.[NaH]

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 3/20 0.36
BTN3A1 O00481 2/20 0.33
ITPR2 Q14571 1/20 0.32
ITPR1 Q14643 1/20 0.32
P2RY2 P41231 1/20 0.31
P2RY4 P51582 1/20 0.31
FDPS P14324 1/20 0.31
BLM P54132 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL28639733 1.00 ITPR3 (0.36) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL1983636 1.00 ITPR3 (0.36) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL28506261 1.00 ITPR3 (0.36) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL5014239 1.00 ITPR3 (0.36) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL28644610 1.00 ITPR3 (0.36) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL23211993 1.00 ITPR3 (0.36) ITPR3BTN3A1ITPR2ITPR1P2RY2
Water SCHEMBL28654980 0.98 ITPR3 (0.35) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL134178 0.98 ITPR3 (0.37) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL544344 0.98 ITPR3 (0.37) ITPR3BTN3A1ITPR2ITPR1P2RY2
SCHEMBL12475062 0.98 ITPR3 (0.37) ITPR3BTN3A1ITPR2ITPR1P2RY2

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
CN-116365081-A Method for stripping lithium ion battery pole piece and application thereof 武汉蔚能电池资产有限公司 2023-06-30 CN disclosed
CN-113365636-A Phosphoinositide compounds for increasing tissue perfusion 萨尼菲特治疗有限公司 2021-09-07 CN disclosed