Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | YAP1 | P46937 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | GHSR | Q92847 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL8322576 | 0.92 | TLR9 (0.42) | TLR9SLC2A1TLR7MTNR1AMTNR1B | |
| SCHEMBL1899359 | 0.90 | TLR9 (0.40) | TLR9TLR7YAP1GHSRPDE4A | |
| SCHEMBL6325760 | 0.90 | TLR9 (0.40) | TLR9TLR7YAP1GHSRPDE4A | |
| SCHEMBL8144740 | 0.86 | GPR119 (0.39) | TLR9TLR7 | |
| SCHEMBL13060966 | 0.83 | TLR9 (0.40) | TLR9TLR7YAP1GHSRPDE4A | |
| SCHEMBL13007045 | 0.83 | TLR9 (0.40) | TLR9TLR7YAP1GHSRPDE4A | |
| SCHEMBL22304240 | 0.82 | TLR9 (0.36) | TLR9TLR7MTNR1AMTNR1BYAP1 | |
| SCHEMBL14527518 | 0.82 | TLR9 (0.40) | TLR9TLR7YAP1GHSRPDE4A | |
| SCHEMBL12529896 | 0.82 | ADH1A (0.45) | TLR9TLR7YAP1GHSRPDE4A | |
| SCHEMBL14037334 | 0.82 | ADH1A (0.45) | TLR9TLR7YAP1GHSRPDE4A |
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 |
|---|---|---|---|---|---|---|---|
| US-5985908-A | MCBI (7-METHOXY-1,2,9A-TETRA-HYDROCYCLOPROPA(C)BENZ(E)INDOL-4-ONE) IS EMPLOYABLE AS A DNA ALKYLATING AGENT AND CAN BE INCORPORATED INTO ANALOGS OF CC-1065 AND THE DUOCARMYCINS FOR | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-11-16 | — | — | US | disclosed |