Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27374180 | 0.81 | CHRNA7 (0.52) | USP2NAPRTCYP1A2CYP2D6CHRNA7 | |
| SCHEMBL2376744 | 0.81 | CHRNB2 (0.48) | NAPRTCYP1A2CYP2D6CHRNA7ALDH1A1 | |
| SCHEMBL27533915 | 0.78 | NAPRT (0.48) | NAPRTCYP1A2CYP2D6CHRNA7ALDH1A1 | |
| SCHEMBL27533556 | 0.78 | NAPRT (0.48) | NAPRTCYP1A2CYP2D6CHRNA7ALDH1A1 | |
| SCHEMBL8925454 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL8754769 | 0.77 | NAPRT (0.47) | NAPRTCYP1A2CYP2D6CHRNA7ALDH1A1 | |
| SCHEMBL28017048 | 0.77 | NAPRT (0.47) | NAPRTCYP1A2CYP2D6CHRNA7ALDH1A1 | |
| SCHEMBL28286055 | 0.77 | CHRNB2 (0.44) | CYP1A2CYP2D6CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL272335 | 0.75 | — | — | |
| SCHEMBL4379548 | 0.75 | ALDH1A1 (0.46) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2882712-A2 | PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS | BIAL - Portela & Cª S.A. (PT) | 2015-06-17 | — | — | EP | disclosed |
| WO-2014017938-A2 | PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS | BIAL - PORTELA & Cª, S.A. (PT) | 2014-01-30 | — | — | WO | disclosed |
| CN-101215246-B | Method for preparing alpha-ketoxime acid ester | UNIV HEBEI SCIENCE & TECH | 2010-08-18 | — | — | CN | disclosed |
| CN-101215246-A | Method for preparing alpha-ketoxime acid ester | UNIV HEBEI SCIENCE & TECH (CN) | 2008-07-09 | — | — | CN | disclosed |
| EP-1511742-A1 | KINASE INHIBITORS | Cytopia PTY Ltd (AU) | 2005-03-09 | — | — | EP | disclosed |
| WO-2003099811-A1 | KINASE INHIBITORS | CYTOPIA PTY LTD (AU) | 2003-12-04 | — | — | WO | disclosed |
| US-5792871-A | BETA-3 AGONIST USEFUL IN TREATMENT OF OBESITY AND DIABETES | MERCK & CO., INC. (US) | 1998-08-11 | — | — | US | disclosed |