Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8158627 | 0.86 | MEN1 (0.32) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL8152609 | 0.84 | CTNNB1 (0.34) | KMT2AMAPTALDH1A1POLBKDM4E | |
| SCHEMBL8144738 | 0.80 | NPC1 (0.38) | MEN1KMT2AMAPTALDH1A1POLB | |
| SCHEMBL8149948 | 0.80 | HPGD (0.34) | GAAMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL8158820 | 0.80 | HTR3A (0.42) | HTR3AGAAMEN1KMT2AMAPT | |
| SCHEMBL8153984 | 0.78 | SMN1; SMN2 (0.35) | MEN1KMT2AMAPTALDH1A1POLB | |
| SCHEMBL8157833 | 0.78 | HTR3A (0.38) | HTR3AGAAMEN1KMT2AMAPT | |
| SCHEMBL8159022 | 0.77 | HDAC3 (0.38) | HTR3AGAAMEN1KMT2AMAPT | |
| SCHEMBL8159020 | 0.77 | HDAC3 (0.38) | HTR3AGAAMEN1KMT2AMAPT | |
| SCHEMBL8155111 | 0.77 | ELANE (0.41) | MEN1KMT2AL3MBTL1NPC1RAB9A |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1019380-A2 | TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS | PHARMACIA & UPJOHN S.p.A. (IT) | 2000-07-19 | — | — | EP | claimed |
| WO-1999016753-A2 | TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS | PHARMACIA & UPJOHN S.P.A. (IT) | 1999-04-08 | — | — | WO | claimed |