Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | VCP | P55072 | 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 | |
|---|---|---|---|---|
| SCHEMBL24911621 | 0.96 | ALDH1A1 (0.47) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL29830533 | 0.96 | ALDH1A1 (0.47) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL24553505 | 0.95 | ALDH1A1 (0.50) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL23142162 | 0.95 | ALDH1A1 (0.53) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL29104474 | 0.95 | ALDH1A1 (0.53) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL29893694 | 0.95 | ALDH1A1 (0.53) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL24948914 | 0.92 | CNR1 (0.48) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL314840 | 0.91 | ALDH1A1 (0.42) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL28464994 | 0.91 | HSD17B10 (0.49) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 | |
| SCHEMBL27012225 | 0.90 | GSTP1 (0.55) | ALDH1A1HPGDCYP3A4HSD17B10GSTP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7396599-B2 | Binuclear organometallic complexes and organic electroluminescent display device using the same | SAMSUNG SDI CO., LTD. (KR) | 2008-07-08 | — | — | US | disclosed |