Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8288701 | 0.88 | ADORA1 (0.55) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL8289859 | 0.85 | MEN1 (0.68) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL8289721 | 0.84 | ALDH1A1 (0.52) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL351566 | 0.84 | KCNH2 (0.66) | ADORA1KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL31208315 | 0.81 | ADORA1 (0.48) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL351992 | 0.80 | ADORA1 (0.82) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL16450569 | 0.80 | KMT2A (0.54) | ADORA1KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL13738138 | 0.79 | NPC1 (0.61) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL17018774 | 0.79 | KCNH2 (0.61) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL13736559 | 0.78 | ADORA1 (0.68) | ADORA1KDM4EL3MBTL1ALDH1A1MEN1 |
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 |