Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.37 |
| ▸ | PIEZO1 | Q92508 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 4/20 | 0.35 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | CYBB | P04839 | 1/20 | 0.34 |
| ▸ | NOX3 | Q9HBY0 | 1/20 | 0.34 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.34 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18586260 | 0.85 | IDO1 (0.39) | IDO1PTPN5PIEZO1DAOTAS2R14 | |
| SCHEMBL475304 | 0.84 | IDO1 (0.41) | PTPN1GSK3BIDO1PTPN5PIEZO1 | |
| SCHEMBL29382636 | 0.84 | IDO1 (0.41) | PTPN1GSK3BIDO1PTPN5PIEZO1 | |
| SCHEMBL3410622 | 0.83 | IDO1 (0.42) | PTPN1GSK3BIDO1PIEZO1DAO | |
| SCHEMBL4597627 | 0.83 | PPARG (0.40) | IDO1PIEZO1DAOMAPTCYP3A4 | |
| SCHEMBL18586969 | 0.81 | IDO1 (0.37) | IDO1PTPN5PIEZO1SIRT2DAO | |
| SCHEMBL27546311 | 0.81 | IDO1 (0.54) | PTPN1GSK3BIDO1PTPN5SIRT2 | |
| SCHEMBL138276 | 0.80 | TAAR1 (0.43) | IDO1PIEZO1DAOTAAR1 | |
| SCHEMBL18587132 | 0.80 | IDO1 (0.36) | IDO1PIEZO1DAOTAS2R14TAAR1 | |
| SCHEMBL18586253 | 0.80 | CTSK (0.36) | PTPN1GSK3BIDO1PIEZO1DAO |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105555783-A | Autotaxin inhibitors comprising a heteroaromatic ring-benzyl-amide-cycle core | NOVARTIS AG | 2016-05-04 | — | — | CN | disclosed |
| CN-104892532-A | Synthetic process of chiral 3-substituted 1,3,4,5-tetrahydro-1,4-benzodiazepine-2-ketone | UNIV CHENGDU TECHNOLOGY | 2015-09-09 | — | — | CN | disclosed |
| CN-101437804-A | Dibenzyl amine compounds and derivatives | PFIZER PROD INC (US) | 2009-05-20 | — | — | CN | disclosed |
| CN-101437803-A | Dibenzyl amine derivatives as CETP inhibitors | PFIZER PROD INC (US) | 2009-05-20 | — | — | CN | disclosed |
| CN-101065366-A | Dibenzyl amine compounds and derivatives | PFIZER PROD INC (US) | 2007-10-31 | — | — | CN | disclosed |