Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.83 |
| ▸ | MAPT | P10636 | 5/20 | 0.83 |
| ▸ | NPC1 | O15118 | 5/20 | 0.83 |
| ▸ | GAA | P10253 | 2/20 | 0.83 |
| ▸ | HTT | P42858 | 1/20 | 0.83 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.83 |
| ▸ | CISD2 | Q8N5K1 | 6/20 | 0.83 |
| ▸ | RAB9A | P51151 | 6/20 | 0.76 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.76 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.76 |
| ▸ | RELA | Q04206 | 3/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | SETD7 | Q8WTS6 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8288705 | 0.91 | CISD2 (1.00) | ALDH1A1MAPTNPC1GAAHTT | |
| SCHEMBL248772 | 0.84 | MAPT (0.75) | ALDH1A1MAPTNPC1GAAHTT | |
| SCHEMBL9400304 | 0.83 | RAB9A (1.00) | ALDH1A1MAPTNPC1GAACISD2 | |
| SCHEMBL6268412 | 0.82 | ALDH1A1 (0.67) | ALDH1A1MAPTNPC1GAAHTT | |
| SCHEMBL8290684 | 0.81 | CISD2 (0.83) | ALDH1A1MAPTNPC1GAAHTT | |
| SCHEMBL6268342 | 0.80 | ALDH1A1 (0.69) | ALDH1A1MAPTNPC1GAAHTT | |
| SCHEMBL25106671 | 0.80 | CISD2 (1.00) | MAPTNPC1CISD2RAB9ANFKB1 | |
| SCHEMBL30300650 | 0.80 | CISD2 (1.00) | MAPTNPC1CISD2RAB9ANFKB1 | |
| SCHEMBL25106684 | 0.80 | CISD2 (1.00) | ALDH1A1MAPTNPC1CISD2RAB9A | |
| SCHEMBL25106697 | 0.79 | CISD2 (0.80) | ALDH1A1MAPTNPC1CISD2RAB9A |
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 |