Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD2 | Q8N5K1 | 9/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.77 |
| ▸ | RAB9A | P51151 | 4/20 | 0.77 |
| ▸ | NPC1 | O15118 | 4/20 | 0.77 |
| ▸ | MAPT | P10636 | 4/20 | 0.77 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.77 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.77 |
| ▸ | RELA | Q04206 | 3/20 | 0.77 |
| ▸ | SETD7 | Q8WTS6 | 4/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 2/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | PKM | P14618 | 1/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | GUSB | P08236 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL25106688 | 0.89 | RAB9A (0.77) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL9400304 | 0.87 | RAB9A (1.00) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL23657451 | 0.85 | RAB9A (0.71) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL13236165 | 0.83 | ALDH1A1 (0.76) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL25106697 | 0.83 | CISD2 (0.80) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL25106677 | 0.81 | CISD2 (1.00) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL25106678 | 0.81 | CISD2 (1.00) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL20838890 | 0.81 | RAB9A (0.69) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL8289765 | 0.81 | ALDH1A1 (0.83) | CISD2ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL25106684 | 0.76 | CISD2 (1.00) | CISD2ALDH1A1RAB9ANPC1MAPT |
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-2005033102-A2 | THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | AMPHORA DISCOVERY CORPORATION (US) | 2005-04-14 | — | — | WO | disclosed |