Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 6/20 | 0.45 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GPR183 | P32249 | 1/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6399053 | 0.83 | GRM5 (0.46) | SRD5A2SRD5A1CYP1A2GRM5MAOA | |
| SCHEMBL16113475 | 0.80 | GPR119 (0.53) | CYP1A2GRM5 | |
| SCHEMBL9137519 | 0.80 | LSS (0.58) | ALDH1A1MAPTGPR183KMT2APOLB | |
| SCHEMBL14720788 | 0.80 | SRD5A2 (0.48) | SRD5A2SRD5A1GPR183 | |
| SCHEMBL19994676 | 0.80 | SRD5A2 (0.48) | ALDH1A1SRD5A2SRD5A1LMNA | |
| SCHEMBL17750085 | 0.80 | LSS (0.51) | L3MBTL1SRD5A2SRD5A1KMT2A | |
| SCHEMBL1483704 | 0.78 | RAB9A (0.53) | ALDH1A1L3MBTL1KDM4ELMNAMIF | |
| SCHEMBL14720576 | 0.77 | SRD5A1 (0.52) | SRD5A2SRD5A1HDAC2 | |
| SCHEMBL14722165 | 0.76 | SRD5A1 (0.51) | SRD5A2SRD5A1HDAC2 | |
| SCHEMBL4980296 | 0.76 | SRD5A2 (0.48) | ALDH1A1KDM4ESRD5A2SRD5A1MAPT |
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-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |