Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | CPB1 | P15086 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | C3AR1 | Q16581 | 4/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8545595 | 0.93 | PKM (0.59) | PKMNPC1MEN1RAB9AKMT2A | |
| Hydrochloric Acid SCHEMBL8540290 | 0.92 | PKM (0.59) | PKMNPC1MEN1RAB9AKMT2A | |
| SCHEMBL8540312 | 0.90 | GRIN2B (0.55) | GRIN2BNPC1FAAHCPB1TDP1 | |
| SCHEMBL8701279 | 0.87 | NPC1 (0.53) | PKMNPC1MEN1RAB9AKMT2A | |
| SCHEMBL8701243 | 0.87 | NPC1 (0.62) | PKMNPC1MEN1RAB9AKMT2A | |
| SCHEMBL8538696 | 0.84 | FAAH (0.50) | GRIN2BMEN1FAAHCPB1POLB | |
| SCHEMBL8541116 | 0.84 | FAAH (0.57) | GRIN2BNPC1FAAHCPB1TDP1 | |
| SCHEMBL8703358 | 0.83 | PKM (0.58) | PKMNPC1MEN1RAB9AKMT2A | |
| SCHEMBL8699553 | 0.83 | PKM (0.52) | PKMNPC1MEN1RAB9AKMT2A | |
| SCHEMBL8703355 | 0.81 | PKM (0.55) | PKMNPC1MEN1RAB9AKMT2A |
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-0705258-A1 | AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY | Knoll AG (DE) | 1996-04-10 | — | — | EP | disclosed |