Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6064220 | 0.81 | CYP11B1 (0.33) | SCN9ACYP11B1CYP11B2PDE10AELANE | |
| SCHEMBL3690622 | 0.76 | ALDH1A1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL5601097 | 0.76 | SCN9A (0.31) | SCN9ACYP11B1CYP11B2 | |
| SCHEMBL6064727 | 0.70 | MAOA (0.36) | — | |
| SCHEMBL2546320 | 0.68 | TSHR (0.46) | CYP11B1CYP11B2PDE10ARECQLELANE | |
| SCHEMBL23840290 | 0.68 | PDE10A (0.45) | CYP11B1CYP11B2PDE10ARECQLMGAM | |
| SCHEMBL4946930 | 0.68 | MEN1 (0.32) | — | |
| SCHEMBL4060837 | 0.68 | CA12 (0.33) | CYP11B2 | |
| SCHEMBL9251286 | 0.68 | — | — | |
| SCHEMBL5616374 | 0.66 | PBRM1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1735354-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | Exxonmobil Chemical Company Inc. (US) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005105864-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-11-10 | — | — | WO | disclosed |