Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.44 |
| ▸ | PTPRB | P23467 | 3/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.44 |
| ▸ | PTPRA | P18433 | 1/20 | 0.44 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | PTPRG | P23470 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9685954 | 0.85 | ALDH1A1 (0.51) | ALDH1A1CYP3A4CYP2C9CYP2C19RECQL | |
| SCHEMBL9687531 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL9555278 | 0.80 | PTPN1 (0.47) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL24872640 | 0.74 | PTPRB (0.55) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL21384832 | 0.74 | PTPN1 (0.45) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL11533573 | 0.74 | CTRB1 (0.51) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL11175367 | 0.73 | PTPRB (0.69) | ALDH1A1PTPN1PTPRBPTPN2PTPRA | |
| SCHEMBL21811199 | 0.72 | MMP8 (0.51) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL14518077 | 0.72 | PTPN1 (0.51) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 | |
| SCHEMBL293540 | 0.72 | MMP8 (0.51) | ALDH1A1CYP3A4CYP2C9CYP2C19PTPN1 |
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-5147952-A | PROCESS FOR PRODUCING MACROMOLECULAR MONOMER | TOAGOSEI CHEMICAL INDUSTRY CO., LTD. (JP) | 1992-09-15 | — | — | US | disclosed |