Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27923863 | 0.82 | NPC1 (0.32) | — | |
| SCHEMBL27901779 | 0.76 | HTR2A (0.38) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL27969609 | 0.76 | HTR2A (0.38) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL27977681 | 0.76 | HTR2A (0.38) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL27663729 | 0.76 | HTR2A (0.38) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL28043614 | 0.74 | HTR2A (0.34) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL1413826 | 0.73 | HDAC9 (0.37) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL29705936 | 0.73 | HTR2A (0.41) | HTR2AHTR2CMEN1MAOBPNMT | |
| Bromide SCHEMBL28138227 | 0.72 | HDAC9 (0.36) | HTR2AHTR2CTSHRTDP1MEN1 | |
| SCHEMBL27969858 | 0.71 | MEN1 (0.40) | HTR2AHTR2CTSHRTDP1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105263924-B | Cxcr7 receptor modulators | 爱杜西亚制药有限公司 | 2018-10-19 | — | — | CN | disclosed |
| CN-107849047-A | Biphenyl derivative, preparation method and medical application thereof | 四川海思科制药有限公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-107849014-A | A kind of biphenyl derivatives and preparation method thereof and purposes in medicine | 四川海思科制药有限公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-106565674-A | Octahydrocyclopentano[c]pyrrole derivatives, and preparation methods and medicinal application thereof | 四川海思科制药有限公司 | 2017-04-19 | — | — | CN | disclosed |
| CN-105263924-A | Cxcr7 receptor modulators | ACTELION PHARMACEUTICALS LTD | 2016-01-20 | — | — | CN | disclosed |
| CN-102083819-B | Novel phenylpyrazinones as kinase inhibitors | HOFFMANN LA ROCHE | 2014-07-09 | — | — | CN | disclosed |
| CN-101932573-B | Pyridinones and Pyridazinones | HOFFMANN LA ROCHE | 2014-06-11 | — | — | CN | disclosed |