Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.46 |
| ▸ | HPGDS | O60760 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14153514 | 0.85 | TAAR1 (0.53) | TAAR1ESR2CHEK2HPGDSPTPN1 | |
| SCHEMBL14153243 | 0.81 | ALOX5 (0.51) | CHEK2PTPN1KDM1APKMALDH1A1 | |
| SCHEMBL31137909 | 0.80 | CYP11B2 (0.46) | TAAR1ESR2CHEK2HPGDSKDM1A | |
| SCHEMBL102455 | 0.80 | PARP1 (0.59) | KDM1APKMPARP1MEN1ALDH1A1 | |
| SCHEMBL102454 | 0.80 | PARP1 (0.59) | KDM1APKMPARP1MEN1ALDH1A1 | |
| SCHEMBL1009422 | 0.79 | GRIN2B (0.58) | TAAR1KDM1ACYP3A4MEN1ALDH1A1 | |
| SCHEMBL1009423 | 0.79 | GRIN2B (0.58) | TAAR1KDM1ACYP3A4MEN1ALDH1A1 | |
| SCHEMBL10092621 | 0.79 | KDM1A (0.54) | KDM1AMEN1ALDH1A1KMT2AGRIN2B | |
| SCHEMBL15547657 | 0.79 | CHEK2 (0.67) | TAAR1ESR2CHEK2HPGDSPTPN1 | |
| SCHEMBL30958375 | 0.79 | CHEK2 (0.67) | TAAR1ESR2CHEK2HPGDSPTPN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012162635-A1 | METABOTROPIC GLUTAMATE RECEPTORS 5 MODULATORS AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2012-11-29 | — | — | WO | disclosed |