Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | PTGES | O14684 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951619 | 0.90 | TACR3 (0.56) | TACR3NPC1RAB9APTGESPTGS2 | |
| SCHEMBL29954658 | 0.86 | NPC1 (0.60) | TACR3NPC1RAB9AKMT2AMAOB | |
| SCHEMBL29950689 | 0.84 | NPC1 (0.64) | NPC1RAB9AATMCA1CA2 | |
| SCHEMBL29957951 | 0.82 | MGLL (0.53) | TACR3NPC1RAB9AATMMAOB | |
| SCHEMBL29952405 | 0.82 | CASP3 (0.54) | NPC1RAB9AKMT2AMAOBMGLL | |
| SCHEMBL27491709 | 0.82 | MAOB (0.58) | TACR3NPC1RAB9AATMMAOB | |
| SCHEMBL8606033 | 0.81 | TACR3 (0.56) | TACR3NPC1RAB9AKMT2AATM | |
| SCHEMBL7954176 | 0.80 | NPC1 (0.50) | TACR3NPC1RAB9AKMT2AATM | |
| SCHEMBL8057733 | 0.80 | MGLL (0.56) | NPC1RAB9AKMT2AMAOBMGLL | |
| SCHEMBL8607650 | 0.79 | POLB (0.55) | TACR3NPC1RAB9AKMT2AATM |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |