Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 6/20 | 0.35 |
| ▸ | HPGD | P15428 | 5/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | AIP | O00170 | 1/20 | 0.34 |
| ▸ | SGTA | O43765 | 1/20 | 0.34 |
| ▸ | TOMM70 | O94826 | 1/20 | 0.34 |
| ▸ | STIP1 | P31948 | 1/20 | 0.34 |
| ▸ | PPP5C | P53041 | 1/20 | 0.34 |
| ▸ | FKBP4 | Q02790 | 1/20 | 0.34 |
| ▸ | PPID | Q08752 | 1/20 | 0.34 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.34 |
| ▸ | FKBP8 | Q14318 | 1/20 | 0.34 |
| ▸ | TOMM34 | Q15785 | 1/20 | 0.34 |
| ▸ | DNAJC7 | Q99615 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14980671 | 0.82 | USP2 (0.37) | CYP1A2ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL14980643 | 0.80 | PLK1 (0.33) | ALDH1A1KMT2AHSD17B10MEN1 | |
| SCHEMBL16366864 | 0.79 | CYP1A2 (0.31) | CYP1A2ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL10679034 | 0.69 | CYP1A2 (0.34) | CYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL14981227 | 0.69 | POLB (0.32) | — | |
| SCHEMBL14981115 | 0.69 | NTRK1 (0.33) | RAB9A | |
| SCHEMBL14980641 | 0.69 | MEN1 (0.31) | ALDH1A1MAPTHPGDRAB9AKMT2A | |
| SCHEMBL14980668 | 0.68 | USP2 (0.38) | BRD4BRPF1EP300CREBBP | |
| SCHEMBL14980659 | 0.62 | ACHE (0.32) | CYP1A2ALDH1A1RAB9AMEN1 | |
| SCHEMBL14191229 | 0.61 | ALDH1A1 (0.47) | CYP1A2ALDH1A1KDM4EMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2411396-B1 | THIENOPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS | GLENMARK PHARMACEUTICALS SA (CH) | 2013-05-29 | — | — | EP | disclosed |