Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | KLK7 | P49862 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.32 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.32 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6480393 | 1.00 | PTPN1 (0.35) | PTPN1NR1H2BRD4MMP2ANPEP | |
| SCHEMBL19566179 | 0.92 | NR1H2 (0.35) | NR1H2CHRM2CHRM1CHRM3KLK7 | |
| SCHEMBL6494880 | 0.86 | KLK7 (0.36) | NR1H2CHRM2CHRM1CHRM3KLK7 | |
| SCHEMBL15659293 | 0.86 | NR1H2 (0.37) | PTPN1NR1H2MMP2ANPEPNR1H3 | |
| SCHEMBL15659291 | 0.86 | NR1H2 (0.37) | PTPN1NR1H2MMP2ANPEPNR1H3 | |
| SCHEMBL18256386 | 0.86 | NR1H2 (0.37) | PTPN1NR1H2MMP2ANPEPNR1H3 | |
| SCHEMBL25842893 | 0.86 | PTPN1 (0.34) | PTPN1NR1H2MMP2ANPEPNR1H3 | |
| Hydrochloric Acid SCHEMBL30661150 | 0.85 | PTPN1 (0.33) | PTPN1NR1H2MMP2ANPEPNR1H3 | |
| SCHEMBL6184927 | 0.85 | FAAH (0.34) | PTPN1NR1H2MMP2ANPEPNR1H3 | |
| SCHEMBL15700777 | 0.85 | FAAH (0.34) | PTPN1NR1H2MMP2ANPEPNR1H3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012154777-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-11-15 | — | — | WO | disclosed |
| WO-2012109080-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-08-16 | — | — | WO | disclosed |