Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.55 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.49 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.49 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.49 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.49 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.49 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.49 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL31559158 | 0.89 | SMPD3 (0.50) | PDE2ASMPD3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8541036 | 0.89 | SMPD3 (0.50) | PDE2ASMPD3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10921944 | 0.84 | SMPD3 (0.47) | PDE2ASMPD3ALDH1A1MAPK1KDM4E | |
| SCHEMBL8542548 | 0.83 | ADRA2A (0.57) | PDE2ASMPD3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11203475 | 0.83 | NOTUM (0.54) | SMPD3CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9634823 | 0.83 | MAOB (0.44) | PDE2ASMPD3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3633273 | 0.82 | SMPD3 (0.50) | SMPD3ALDH1A1GAAMAPK1HTT | |
| SCHEMBL31429681 | 0.82 | NOTUM (0.53) | SMPD3ALDH1A1GAAMAPK1ADRA2A | |
| SCHEMBL8540690 | 0.82 | ADRA2A (0.46) | SMPD3CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6722647 | 0.82 | AMY1A (0.55) | SMPD3CYP1A2CYP3A4CYP2D6CYP2C9 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114315754-A | Hydroxamic acid compound and application thereof | 南方医科大学 | 2022-04-12 | — | — | CN | disclosed |
| CN-106699771-A | Cryptotanshinone compound, as well as preparation method and application thereof | 常州大学 | 2017-05-24 | — | — | CN | disclosed |
| CN-102712074-B | Polishing pad | TOYO TIRE & RUBBER CO.,LTD. (JP) | 2016-01-20 | — | — | CN | disclosed |
| EP-1678185-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042542-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2005-05-12 | — | — | WO | disclosed |
| EP-0857171-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-08-12 | — | — | EP | disclosed |
| WO-1997015555-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-05-01 | — | — | WO | disclosed |
| EP-0079083-A1 | New imidazo[4,5-c]pyridine derivatives, processes for their preparation and pharmaceutical formulations containing such compounds | MERCK PATENT GmbH (DE) | 1983-05-18 | — | — | EP | disclosed |