Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | GABRP | O00591 | 2/20 | 0.42 |
| ▸ | GABRD | O14764 | 2/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.42 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.42 |
| ▸ | GABRE | P78334 | 2/20 | 0.42 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.42 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.42 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.42 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27524423 | 0.81 | IDO1 (0.51) | MEN1KMT2AGABRPGABRDGABRA1 | |
| SCHEMBL27362975 | 0.81 | PIM1 (0.51) | MEN1KMT2AGABRPGABRDGABRA1 | |
| SCHEMBL29414926 | 0.79 | CHRM1 (0.59) | MEN1KMT2AGABRPGABRDGABRA1 | |
| SCHEMBL29611554 | 0.79 | GABRA1 (0.61) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL11460470 | 0.79 | CHRM1 (0.59) | MEN1KMT2AGABRPGABRDGABRA1 | |
| SCHEMBL11467997 | 0.79 | GABRA1 (0.61) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL5094507 | 0.79 | LMNA (0.50) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL27363984 | 0.78 | MEN1 (0.39) | MEN1KMT2AGABRPGABRDGABRA1 | |
| SCHEMBL8844868 | 0.77 | KMT2A (1.00) | MEN1KMT2AGABRPGABRDGABRA1 | |
| SCHEMBL30289323 | 0.77 | KMT2A (1.00) | MEN1KMT2AGABRPGABRDGABRA1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100516034-C | Aspartyl protease inhibitors | VERTEX PHARMA CO LTD (US) | 2009-07-22 | — | — | CN | claimed |
| CN-101245058-A | Inhibitors of aspartyl protease | VERTEX PHARMA (US) | 2008-08-20 | — | — | CN | claimed |
| CN-100516034-C | Aspartyl protease inhibitors | VERTEX PHARMA CO LTD (US) | 2009-07-22 | — | — | CN | disclosed |
| CN-101245058-A | Inhibitors of aspartyl protease | VERTEX PHARMA (US) | 2008-08-20 | — | — | CN | disclosed |
| CN-1213746-C | Immunopotentiatory agents and physiologically acceptable salts thereof | WELLCOME FOUND (GB) | 2005-08-10 | — | — | CN | disclosed |