Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8048733 | 0.91 | PTPN1 (0.48) | PTPN1SLC2A1CYP19A1CYP3A4CYP3A5 | |
| SCHEMBL201758 | 0.80 | PTPN1 (0.47) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL450726 | 0.78 | PTPN1 (0.48) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL28871 | 0.76 | HDAC8 (0.59) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL720150 | 0.76 | PTPN1 (0.47) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL165547 | 0.74 | KIF11 (0.52) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL202305 | 0.74 | PTPN1 (0.55) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL5181294 | 0.74 | ESR1 (0.46) | PTPN1HDAC8CA12CA1CA2 | |
| SCHEMBL12238654 | 0.73 | PTPN1 (0.42) | PTPN1HDAC8CA12CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL22721248 | 0.73 | HDAC8 (0.56) | PTPN1HDAC8CA12CA1CA2 |
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-6140503-A | Organometallic compounds | ACADEMIA SINICA (TW) | 2000-10-31 | — | — | US | disclosed |