Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3575514 | 0.81 | IGF1R (0.35) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL3579630 | 0.75 | FABP3 (0.42) | GABRA1 | |
| SCHEMBL4552205 | 0.75 | — | — | |
| SCHEMBL3575608 | 0.73 | ALDH1A1 (0.42) | — | |
| SCHEMBL3585516 | 0.72 | LDHA (0.33) | — | |
| SCHEMBL3584691 | 0.64 | RAB9A (0.56) | — | |
| SCHEMBL13983006 | 0.62 | ALDH1A1 (0.63) | — | |
| SCHEMBL5357593 | 0.61 | MAPT (0.41) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL6321766 | 0.60 | CYP1A2 (0.58) | — | |
| SCHEMBL2403427 | 0.60 | HCAR3 (0.43) | GABRA1 |
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-2076492-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | Merck & Co., Inc. (US) | 2009-07-08 | — | — | EP | disclosed |
| WO-2008054605-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2008-05-08 | — | — | WO | disclosed |