Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1359878 | 0.91 | ABL1 (0.41) | MAOBABL1CFTRMEN1RAB9A | |
| SCHEMBL1359735 | 0.88 | CYP3A4 (0.46) | MAOBALDH1A1SMN1; SMN2ABL1CFTR | |
| SCHEMBL1359032 | 0.85 | SIRT1 (0.43) | LMNAALDH1A1HTTABL1MEN1 | |
| SCHEMBL1359292 | 0.85 | CYP3A4 (0.38) | ABL1CFTRMAPTCYP3A4 | |
| SCHEMBL1359885 | 0.84 | NFATC1 (0.45) | ABL1CFTRCYP3A4 | |
| SCHEMBL1360340 | 0.82 | NAPRT (0.40) | MAOBABL1MAPTCYP3A4 | |
| SCHEMBL1358064 | 0.82 | CYP3A4 (0.38) | MAOBSMN1; SMN2ABL1MEN1KMT2A | |
| SCHEMBL1359548 | 0.82 | BRAF (0.36) | MAOBCYP3A4 | |
| SCHEMBL1358066 | 0.80 | MAOB (0.42) | MAOBALDH1A1ABL1CYP3A4 | |
| SCHEMBL1359236 | 0.80 | RAB9A (0.54) | LMNAALDH1A1SMN1; SMN2MEN1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8067442-B2 | Heterocyclic antiviral compounds | ROCHE PALO ALTO LLC (US) | 2011-11-29 | — | — | US | claimed |
| EP-2334662-A1 | PYRINE OR PYRAZINE DERIVATIVES FOR TREATING HCV | F. Hoffmann-La Roche AG (CH) | 2011-06-22 | — | — | EP | claimed |