Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5578712 | 0.91 | HDAC1 (0.43) | HDAC1HDAC6SIGMAR1SLC18A3PTGDR2 | |
| SCHEMBL5579054 | 0.88 | CYP2D6 (0.44) | HDAC1HDAC6ALDH1A1GAAHPGD | |
| SCHEMBL5578500 | 0.87 | HDAC1 (0.43) | HDAC1HDAC6SIGMAR1SLC18A3NOTUM | |
| SCHEMBL5578688 | 0.87 | HDAC1 (0.48) | HDAC1HDAC6SIGMAR1SLC18A3PTGDR2 | |
| SCHEMBL5578443 | 0.85 | NOTUM (0.40) | HDAC1HDAC6SIGMAR1SLC18A3PTGDR2 | |
| SCHEMBL5578784 | 0.85 | TSHR (0.42) | HDAC1HDAC6ALDH1A1GAAMAPT | |
| SCHEMBL5578604 | 0.85 | HDAC1 (0.36) | HDAC1HDAC6SIGMAR1SLC18A3PTGDR2 | |
| SCHEMBL5578768 | 0.85 | HDAC1 (0.41) | HDAC1HDAC6ALDH1A1KDM4ELMNA | |
| SCHEMBL5578902 | 0.85 | NQO2 (0.41) | HDAC1HDAC6PTGDR2ALDH1A1 | |
| SCHEMBL14618893 | 0.85 | OPRM1 (0.43) | HDAC1HDAC6SIGMAR1SLC18A3OPRK1 |
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-2005063745-A9 | NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF | ARENA PHARM INC (US) | 2007-02-01 | — | — | WO | disclosed |