Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 6/20 | 0.54 |
| ▸ | NAMPT | P43490 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | IDH2 | P48735 | 1/20 | 0.41 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.40 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.40 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.40 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7978263 | 0.82 | NAMPT (0.49) | SERPINE1NAMPTTSHRHSD17B2KMT2A | |
| SCHEMBL8195511 | 0.81 | HTT (0.55) | SERPINE1NAMPTKMT2A | |
| SCHEMBL7978261 | 0.76 | NAMPT (0.55) | SERPINE1NAMPTTSHRHSD17B2KMT2A | |
| SCHEMBL8201130 | 0.75 | TSHR (0.46) | SERPINE1NAMPTTSHRHSD17B2KMT2A | |
| SCHEMBL19639260 | 0.69 | NR3C1 (0.55) | SERPINE1NAMPTTSHRHSD17B2KMT2A | |
| SCHEMBL8201250 | 0.69 | CYP17A1 (0.43) | NAMPTTSHRKMT2AHDAC1 | |
| SCHEMBL12505777 | 0.67 | HDAC6 (0.54) | SERPINE1KMT2AHDAC8 | |
| SCHEMBL2689551 | 0.67 | HDAC1 (0.67) | SERPINE1TSHRHSD17B2KMT2ANR3C1 | |
| SCHEMBL7572806 | 0.66 | NR3C1 (0.69) | SERPINE1TSHRHSD17B2KMT2ANR3C1 | |
| SCHEMBL3558864 | 0.66 | NR3C1 (0.59) | SERPINE1TSHRHSD17B2KMT2ANR3C1 |
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-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | claimed |