Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 7/20 | 0.47 |
| ▸ | ACHE | P22303 | 6/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4032463 | 0.92 | CCR3 (0.47) | BCHEACHEGAAKMT2AFAAH | |
| SCHEMBL4040634 | 0.86 | BCHE (0.44) | BCHEACHEMAOBGAAPKM | |
| SCHEMBL3914967 | 0.85 | FAAH (0.52) | GAAPKMFAAHALDH1A1MAPT | |
| SCHEMBL3914881 | 0.82 | KMT2A (0.51) | KMT2AALDH1A1MEN1LMNAMAPT | |
| SCHEMBL2940834 | 0.82 | CXCR3 (0.38) | KMT2A | |
| SCHEMBL4039209 | 0.82 | CXCR3 (0.38) | KMT2A | |
| SCHEMBL3926088 | 0.80 | CXCR3 (0.41) | GAA | |
| SCHEMBL1797763 | 0.78 | CYP2D6 (0.51) | GAAKMT2AALDH1A1MEN1 | |
| SCHEMBL4032741 | 0.78 | ATM (0.44) | KMT2ACCR3ALDH1A1MEN1MAPT | |
| Hydrochloric Acid SCHEMBL1800654 | 0.77 | CYP2D6 (0.50) | GAAKMT2AALDH1A1MEN1 |
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-1730144-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5 DECAN-2-ONE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2009-06-10 | — | — | EP | claimed |
| EP-1730144-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5 DECAN-2-ONE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2009-06-10 | — | — | EP | disclosed |