Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 5/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27495164 | 0.87 | CYP3A4 (0.50) | BLMESR1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL28272596 | 0.86 | CYP3A4 (0.49) | BLMCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL27586112 | 0.86 | CYP3A4 (0.49) | BLMCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL27734453 | 0.86 | CYP3A4 (0.49) | BLMESR1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL27915722 | 0.86 | CYP3A4 (0.49) | BLMCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL2491151 | 0.84 | CYP3A4 (0.48) | BLMCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL27484098 | 0.84 | CYP2C19 (0.68) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| SCHEMBL27495398 | 0.84 | CYP3A4 (0.48) | BLMESR1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL27926127 | 0.84 | CYP3A4 (0.48) | BLMCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL3656311 | 0.84 | SMN1; SMN2 (0.48) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103242192-B | The inhibitor of 11-beta-hydroxysteroid dehydrogenase 1 type enzyme | ABBVIE INC. (US) | 2016-05-04 | — | — | CN | disclosed |
| CN-105408312-A | Quinoline derivatives | ONO PHARMACEUTICAL CO | 2016-03-16 | — | — | CN | disclosed |
| CN-105026387-A | Pyridine derivatives as soft rock inhibitors | AMAKEM NV | 2015-11-04 | — | — | CN | disclosed |
| CN-102741240-B | Pyrimidine compounds as delta opioid receptor modulators | JANSSEN PHARMACEUTICA NV | 2015-05-06 | — | — | CN | disclosed |
| CN-101541783-B | pyridinonyl PDK1 inhibitors | SUNESIS PHARMACEUTICALS, INC. (US) | 2014-10-01 | — | — | CN | disclosed |
| CN-103242192-A | Inhibitors of the 11-beta-hydroxysteroid dehydrogenase Type 1 enzyme | ABBVIE INC | 2013-08-14 | — | — | CN | disclosed |
| CN-102741240-A | Pyrimidine compounds as delta opioid receptor modulators | JANSSEN PHARMACEUTICA NV | 2012-10-17 | — | — | CN | disclosed |
| CN-101720319-A | Thiazolidine derivatives and methods for the preparation thereof | KAINOS MEDICINE INC | 2010-06-02 | — | — | CN | disclosed |
| CN-101679261-A | Piperazine and piperidine mglur5 potentiators | ASTRAZENECA AB | 2010-03-24 | — | — | CN | disclosed |
| CN-100562319-C | 2-cyanopyrrole and pyrimidine and its pharmaceutical use | NOVARTIS AG (CH) | 2009-11-25 | — | — | CN | disclosed |
| CN-101541783-A | Pyridinonyl PDK1 inhibitors | SUNESIS PHARMACEUTICALS (US) | 2009-09-23 | — | — | CN | disclosed |
| CN-101443334-A | Anti-viral compounds | ABBOTT LAB (US) | 2009-05-27 | — | — | CN | disclosed |
| CN-101384591-A | Antiviral compounds | ABBOTT LAB (US) | 2009-03-11 | — | — | CN | disclosed |
| CN-100402510-C | Oxazole derivatives and their use as insulin sensitizers | HOFFMANN LA ROCHE (CH) | 2008-07-16 | — | — | CN | disclosed |
| CN-101137616-A | Inhibitors of 11-beta-hydroxysteroid dehydrogenase type 1 enzyme | ABBOTT LAB (US) | 2008-03-05 | — | — | CN | disclosed |
| CN-1809541-A | Aniline derivatives | HOFFMANN LA ROCHE (CH) | 2006-07-26 | — | — | CN | disclosed |
| CN-1756553-A | 2-cyanopyrrolopyrimidines and pharmaceutical uses thereof | NOVARTIS AG (CH) | 2006-04-05 | — | — | CN | disclosed |
| CN-1668606-A | Oxazole derivatives and their use as insulin sensitizers | HOFFMANN LA ROCHE (CH) | 2005-09-14 | — | — | CN | disclosed |
| CN-1208329-C | Novel aniline derivative | HOFFMANN LA ROCHE (CH) | 2005-06-29 | — | — | CN | disclosed |
| CN-1443179-A | Aniline derivatives | HOFFMANN LA ROCHE (CH) | 2003-09-17 | — | — | CN | disclosed |