Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 2/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.38 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.38 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2415029 | 0.86 | MRGPRX4 (0.45) | PDE2AMRGPRX4KMT2AMEN1 | |
| SCHEMBL28549368 | 0.81 | CES2 (0.47) | PDE2AMGLLORAI1ORAI2ORAI3 | |
| SCHEMBL28949758 | 0.80 | CES2 (0.46) | PDE2AHTR2AMGLLORAI1ORAI2 | |
| SCHEMBL27729540 | 0.80 | IDO1 (0.41) | PDE2AMRGPRX4MGLLORAI1ORAI2 | |
| SCHEMBL27658717 | 0.80 | TRPV6 (0.44) | KCNH2MGLLORAI1ORAI2ORAI3 | |
| SCHEMBL10933173 | 0.79 | NOTUM (0.43) | PDE2AHTR2ASLC6A4KCNH2MRGPRX4 | |
| SCHEMBL31072357 | 0.77 | MAPT (0.43) | HTR2AORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL28328459 | 0.77 | FFAR4 (0.40) | KCNH2MRGPRX4MAPTCYP3A4CYP2C9 | |
| SCHEMBL31053746 | 0.76 | CES2 (0.46) | SLC6A4MGLLORAI1ORAI2ORAI3 | |
| SCHEMBL31351020 | 0.76 | PDE2A (0.42) | PDE2AMRGPRX4MGLLORAI1ORAI2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102066359-B | Novel heteroaryl carboxamide derivatives | HOFFMANN LA ROCHE | 2013-08-21 | — | — | CN | disclosed |
| CN-101155781-B | Pyridine-3-carboxamide derivatives as cb1 inverse agonists | HOFFMANN LA ROCHE | 2012-11-07 | — | — | CN | disclosed |
| CN-102066359-A | Novel heteroaryl carboxamide derivatives | HOFFMANN LA ROCHE | 2011-05-18 | — | — | CN | disclosed |
| CN-101522626-A | 3-pyridinecarboxamide and 2-pyrazinecarboxamide derivatives as HDL-cholesterol raising agents | HOFFMANN LA ROCHE (CH) | 2009-09-02 | — | — | CN | disclosed |
| CN-101163478-A | Compounds for inflammation and immune-related uses | SYNTA PHARMACEUTICALS CORP (US) | 2008-04-16 | — | — | CN | disclosed |
| CN-101155781-A | Pyridine-3-carboxamide derivatives as cb1 inverse agonists | HOFFMANN LA ROCHE (CH) | 2008-04-02 | — | — | CN | disclosed |