Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.68 |
| ▸ | HPGD | P15428 | 6/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.68 |
| ▸ | LMNA | P02545 | 4/20 | 0.68 |
| ▸ | RAB9A | P51151 | 7/20 | 0.60 |
| ▸ | NPC1 | O15118 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.60 |
| ▸ | TP53 | P04637 | 2/20 | 0.60 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 11/20 | 0.59 |
| ▸ | MEN1 | O00255 | 5/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP7 | P55210 | 1/20 | 0.56 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL7003777 | 0.84 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL16246255 | 0.81 | HPGD (0.59) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL7002469 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL4140802 | 0.79 | KMT2A (0.56) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL16263740 | 0.77 | ALDH1A1 (0.54) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL31700539 | 0.77 | ALDH1A1 (0.84) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL16246265 | 0.76 | MAPT (0.56) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL7003934 | 0.76 | ALDH1A1 (0.70) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL7673789 | 0.75 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4ELMNARAB9A | |
| SCHEMBL6999632 | 0.75 | RAB9A (0.62) | ALDH1A1HPGDKDM4ELMNARAB9A |
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 |