Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7359573 | 0.91 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNAMAPTHPGD | |
| SCHEMBL6811090 | 0.91 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTCA1CA2 | |
| SCHEMBL7359851 | 0.87 | ALDH1A1 (0.56) | ALDH1A1LMNAMAPTCA1CA2 | |
| SCHEMBL7362562 | 0.86 | ALDH1A1 (0.58) | ALDH1A1LMNAMAPTCA1CA2 | |
| SCHEMBL9275919 | 0.81 | PDE4D (0.53) | ALDH1A1 | |
| SCHEMBL7361910 | 0.80 | MAPT (0.66) | NOX4ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL7358841 | 0.76 | CA12 (0.69) | ALDH1A1LMNAMAPTCA1CA2 | |
| SCHEMBL2746659 | 0.75 | MTNR1A (0.61) | NOX4ALDH1A1LMNAMTNR1AMTNR1B | |
| SCHEMBL7348827 | 0.74 | PDE4D (0.52) | — | |
| SCHEMBL9269689 | 0.73 | KMT2A (0.59) | ALDH1A1LMNAMAPTHPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0538384-A4 | OXAMIDES | SMITHKLINE BEECHAM CORP (US) | 1995-04-12 | — | — | EP | disclosed |
| US-5393788-A | Phenylalkyl oxamides | SMITHKLINE BEECHAM CORPORATION (US) | 1995-02-28 | — | — | US | disclosed |
| EP-0538384-A1 | OXAMIDES | SMITHKLINE BEECHAM CORPORATION (US) | 1993-04-28 | — | — | EP | disclosed |
| CN-1060652-A | OXAMIDES | SMITHKLINE BEECHAM CORP (US) | 1992-04-29 | — | — | CN | disclosed |
| WO-1992000968-A1 | OXAMIDES | SMITHKLINE BEECHAM CORPORATION (US) | 1992-01-23 | — | — | WO | disclosed |