Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.53 |
| ▸ | MAOB | P27338 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | GSK3B | P49841 | 2/20 | 0.47 |
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
| ▸ | TACR2 | P21452 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3919086 | 0.80 | MAOA (0.52) | MAOAMAOBRAB9AGSK3BALDH1A1 | |
| SCHEMBL19923160 | 0.80 | MAOA (0.52) | MAOAMAOBRAB9AGSK3BALDH1A1 | |
| SCHEMBL11890529 | 0.80 | ALDH1A1 (0.49) | MAOAMAOBRAB9AGSK3BALDH1A1 | |
| SCHEMBL19806850 | 0.78 | GSTP1 (0.44) | GSK3BBACE1LCKGSTP1 | |
| SCHEMBL158270 | 0.78 | RAB9A (0.68) | MAOAMAOBRAB9AGSK3BBACE1 | |
| SCHEMBL5213883 | 0.78 | MAOA (0.68) | MAOAMAOBRAB9ALCKALDH1A1 | |
| SCHEMBL6232167 | 0.77 | ALDH1A1 (0.65) | MAOAMAOBRAB9AGSK3BALDH1A1 | |
| SCHEMBL29446267 | 0.76 | TACR2 (0.62) | MAOAMAOBRAB9AGSK3BALDH1A1 | |
| SCHEMBL584489 | 0.76 | TACR2 (0.62) | MAOAMAOBRAB9AGSK3BALDH1A1 | |
| SCHEMBL865349 | 0.76 | RAB9A (0.71) | MAOAMAOBRAB9AGSK3BBACE1 |
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-6495580-B1 | A BENZYLIDENE DERIVATIVE CONTAINING HETEROCYCLIC RING IS USEFUL AS PNEUMOVIRUS INHIBITOR | VIROPHARMA INCORPORATED | 2002-12-17 | — | — | US | disclosed |