Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.50 |
| ▸ | MC4R | P32245 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.43 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5460089 | 0.91 | CYP2D6 (0.53) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL7392205 | 0.91 | CYP2D6 (0.53) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL7386739 | 0.91 | CYP2D6 (0.53) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL28295976 | 0.87 | CYP2D6 (0.51) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL19850974 | 0.87 | CYP2D6 (0.51) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL9820720 | 0.87 | CYP2D6 (0.51) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL25740901 | 0.87 | CYP2D6 (0.51) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL8477448 | 0.85 | L3MBTL3 (0.46) | CYP2D6ALDH1A1KMT2AOPRM1OPRD1 | |
| SCHEMBL25278704 | 0.80 | CYP2D6 (0.55) | CYP2D6MC4RLMNASMN1; SMN2HTT | |
| SCHEMBL25278705 | 0.80 | CYP2D6 (0.55) | CYP2D6MC4RLMNASMN1; SMN2HTT |
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-2421867-A2 | PIPERIDINE INHIBITORS OF JANUS KINASE 3 | Auspex Pharmaceuticals, Llc (US) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010123919-A2 | PIPERIDINE INHIBITORS OF JANUS KINASE 3 | AUSPEX PHARMACEUTICALS, LLC (US) | 2010-10-28 | — | — | WO | disclosed |