Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16498161 | 0.87 | SYK (0.44) | RAB9ASMN1; SMN2NAPRTSORT1DHODH | |
| SCHEMBL16498113 | 0.84 | NAPRT (0.41) | SMN1; SMN2NAPRTPTGER4DHODHKDM4E | |
| SCHEMBL16498109 | 0.80 | CYP11B1 (0.48) | NAPRTPTGER4 | |
| SCHEMBL2454494 | 0.77 | ALDH1A1 (0.59) | RAB9ASMN1; SMN2CA12CA1CA2 | |
| SCHEMBL16498273 | 0.76 | NAPRT (0.39) | CYP2C19NAPRTPTGER4DHODHKDM4E | |
| SCHEMBL16498677 | 0.76 | LRRK2 (0.48) | PTGER4ALDH1A1LMNAMAPT | |
| SCHEMBL16498549 | 0.75 | NAPRT (0.40) | CYP1A2NAPRTPTGER4DHODHGABRA1 | |
| SCHEMBL1505109 | 0.74 | PTGER4 (0.41) | PTGER4KDM4E | |
| SCHEMBL16498125 | 0.74 | PTGER4 (0.37) | NAPRTPTGER4GABRA1GABRG2GABRB3 | |
| SCHEMBL1505139 | 0.73 | PTGER4 (0.40) | RAB9APTGER4KDM4ESYKHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011151651-A1 | BENZODIAZEPINE COMPOUNDS USEFUL FOR THE TREATMENT OF HEPATITIS C | ARROW THERAPEUTICS LIMITED (GB) | 2011-12-08 | — | — | WO | disclosed |