Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 2/20 | 0.52 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.52 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.52 |
| ▸ | ADH5 | P11766 | 9/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 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 | |
|---|---|---|---|---|
| SCHEMBL3850436 | 0.82 | ADH5 (0.67) | PDE4APDE4BPDE4CPDE4DADH5 | |
| SCHEMBL26614123 | 0.79 | ADH5 (0.54) | ADH5CYP3A4BAZ2BDHODHKDM4E | |
| SCHEMBL15924858 | 0.79 | ADH5 (0.64) | ADH5CYP3A4BAZ2BDHODHSMN1; SMN2 | |
| SCHEMBL12121100 | 0.79 | CYP2D6 (0.60) | PDE4APDE4BPDE4CPDE4DADH5 | |
| SCHEMBL12316378 | 0.79 | CYP11B1 (0.52) | ADH5CYP3A4BAZ2BDHODHKDM4E | |
| SCHEMBL4674986 | 0.79 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4DADH5 | |
| SCHEMBL26614180 | 0.77 | ADH5 (0.54) | ADH5CYP3A4BAZ2BDHODHKDM4E | |
| SCHEMBL5806043 | 0.76 | CYP11B1 (0.52) | ADH5CYP3A4BAZ2BDHODHKDM4E | |
| SCHEMBL14741230 | 0.76 | ADH5 (0.50) | PDE4APDE4BPDE4CPDE4DADH5 | |
| Propionic Acid SCHEMBL29217936 | 0.74 | CYP3A4 (0.50) | PDE4APDE4BPDE4CPDE4DADH5 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006058535-A2 | NOVEL N-HETEROCYCLIC PLATINUM AND PALLADIUM CARBENE COMPLEXES, PRODUCTION AND USE THEREOF FOR THE PARTIAL OXIDATION OF HYDROCARBONS | Technische Universität Dresden (DE) | 2006-06-08 | — | — | WO | disclosed |
| EP-0496237-B1 | N-imidazolyl derivatives of substituted tetrahydrocarbazole and cyclohept[b]indole | PHARMACIA SPA (IT) | 1996-02-14 | — | — | EP | disclosed |
| US-5246957-A | Thromboxane A2 synthesis for cardiovascular disorders | FARMITALIA CARLO ERBA S.R.L. (IT) | 1993-09-21 | — | — | US | disclosed |
| US-5238953-A | Thromboxane a2 antagonist | FARMITALIA CARLO ERBA S.R.L. (IT) | 1993-08-24 | — | — | US | disclosed |
| EP-0510398-A2 | N-Imidazolyl derivatives of substituted indole | PHARMACIA S.p.A. (IT) | 1992-10-28 | — | — | EP | disclosed |
| EP-0496237-A2 | N-imidazolyl derivatives of substituted tetrahydrocarbazole and cyclohept[b]indole | PHARMACIA S.p.A. (IT) | 1992-07-29 | — | — | EP | disclosed |