Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | AGXT | P21549 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15544922 | 0.81 | MMP2 (0.42) | HTR2ASLC6A4ALDH1A1MEN1POLB | |
| SCHEMBL11308859 | 0.81 | IDO1 (0.40) | HTR2ASLC6A4KCNH2SGMS2ALDH1A1 | |
| SCHEMBL96253 | 0.78 | IDO1 (0.58) | ALDH1A1MEN1POLBHPGDKMT2A | |
| SCHEMBL16545839 | 0.78 | SRC (0.33) | HPGDSRC | |
| SCHEMBL16141987 | 0.76 | HTR2A (0.42) | HTR2ASLC6A4KCNH2SGMS2HTR2C | |
| SCHEMBL29956098 | 0.76 | HTR2A (0.39) | HTR2ASLC6A4KCNH2ALDH1A1MEN1 | |
| SCHEMBL9939734 | 0.76 | HTR2A (0.39) | HTR2ASLC6A4KCNH2ALDH1A1MEN1 | |
| SCHEMBL8184326 | 0.74 | ALDH1A1 (0.48) | HTR2ASLC6A4KCNH2ALDH1A1MEN1 | |
| SCHEMBL98918 | 0.73 | IDO1 (0.55) | HPGDIDO1L3MBTL1 | |
| SCHEMBL25292281 | 0.73 | HTR2A (0.38) | HTR2ASLC6A4KCNH2ALDH1A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2885307-A1 | 1-PHENYL-SUBSTITUTED HETEROCYCLYL DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS | Actelion Pharmaceuticals Ltd. (CH) | 2015-06-24 | — | — | EP | disclosed |
| WO-2014006585-A1 | 1-PHENYL-SUBSTITUTED HETEROCYCLYL DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2014-01-09 | — | — | WO | disclosed |