Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8047439 | 0.91 | PTPN1 (0.50) | PTPN1CYP19A1CYP3A4CYP3A5SLC2A1 | |
| SCHEMBL16051240 | 0.82 | PTPN1 (0.47) | PTPN1CYP3A4TSHRCYP2C9 | |
| SCHEMBL29044834 | 0.82 | PTPN1 (0.47) | PTPN1CYP3A4TSHRCYP2C9 | |
| SCHEMBL5180369 | 0.82 | PTPN1 (0.47) | PTPN1CYP3A4TSHRCYP2C9 | |
| SCHEMBL9050608 | 0.81 | CYP19A1 (0.54) | CYP19A1CYP3A4TSHRCRHBPCRHR2 | |
| SCHEMBL914557 | 0.78 | CYP3A4 (0.57) | CYP19A1CYP3A4CYP3A5TSHR | |
| Triphenylmethanol SCHEMBL1332873 | 0.78 | CYP19A1 (0.50) | PTPN1CYP19A1CYP3A4TSHRCRHBP | |
| Triphenylmethanol SCHEMBL700 | 0.78 | CYP19A1 (0.50) | PTPN1CYP19A1CYP3A4TSHRCRHBP | |
| Triphenylmethanol SCHEMBL456603 | 0.78 | CYP19A1 (0.50) | PTPN1CYP19A1CYP3A4TSHRCRHBP | |
| Triphenylmethanol SCHEMBL1565321 | 0.75 | CYP19A1 (0.48) | PTPN1CYP19A1CYP3A4TSHRCRHBP |
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 |