Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYSLTR1 | Q9Y271 | 4/20 | 0.45 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
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 SCHEMBL8843526 | 0.98 | CYP1A2 (0.49) | CYP1A2HDAC1HDAC2HDAC8MAPT | |
| SCHEMBL29858336 | 0.80 | NPSR1 (0.64) | CYP1A2HDAC1HDAC2HDAC8MAPT | |
| SCHEMBL19407338 | 0.80 | NPSR1 (0.64) | CYP1A2HDAC1HDAC2HDAC8MAPT | |
| SCHEMBL28205113 | 0.77 | HDAC1 (0.57) | CYP1A2HDAC1HDAC2HDAC8MEN1 | |
| SCHEMBL8843570 | 0.77 | CYP1A2 (0.51) | CYP1A2HDAC1HDAC2HDAC8MAPT | |
| SCHEMBL3951224 | 0.76 | GPBAR1 (0.55) | CYP1A2MAPTMEN1NPC1RAB9A | |
| SCHEMBL10980763 | 0.75 | CYP1A2 (0.53) | CYP1A2MAPTMEN1NPC1RAB9A | |
| SCHEMBL3807364 | 0.75 | NOTUM (0.40) | CYP1A2HDAC1HDAC2NPC1RAB9A | |
| SCHEMBL15578063 | 0.74 | HDAC1 (0.61) | CYP1A2HDAC1HDAC2HDAC8MAPT | |
| SCHEMBL7832872 | 0.74 | HDAC1 (0.54) | CYP1A2HDAC1HDAC2HDAC8MAPT |
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-5672615-A | MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS | NOVARTIS CORPORATION (US) | 1997-09-30 | — | — | US | disclosed |