Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 6/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6310651 | 0.85 | GRM5 (0.54) | GRM5ALDH1A1GAAKDM4ERAB9A | |
| SCHEMBL9445826 | 0.72 | GRM5 (0.64) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL4457730 | 0.72 | GRM5 (0.64) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL12599210 | 0.70 | GRM5 (0.48) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL9715647 | 0.70 | GRM5 (0.61) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL4138997 | 0.68 | KDM4E (0.58) | ALDH1A1GAAKDM4ERAB9A | |
| SCHEMBL30278513 | 0.67 | GRM5 (0.68) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL10060648 | 0.65 | GRM5 (0.47) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL17378288 | 0.65 | GRM5 (0.61) | GRM5CA12CA1CA2CA9 | |
| SCHEMBL873622 | 0.65 | — | — |
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-9127021-B2 | Hepatitis C virus inhibitors | ENANTA PHARMACEUTICALS, INC. (US) | 2015-09-08 | — | — | US | disclosed |