Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | NAMPT | P43490 | 2/20 | 0.50 |
| ▸ | CTSK | P43235 | 2/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | PPARA | Q07869 | 3/20 | 0.46 |
| ▸ | PPARD | Q03181 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | SDCBP | O00560 | 1/20 | 0.45 |
| ▸ | SDC2 | P34741 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | F10 | P00742 | 1/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7457288 | 0.91 | HDAC1 (0.53) | HDAC1NAMPTCTSKCTSSPPARG | |
| SCHEMBL7446916 | 0.91 | HDAC1 (0.50) | HDAC1NAMPTCTSKCTSSMEN1 | |
| SCHEMBL7446767 | 0.89 | HDAC1 (0.48) | HDAC1NAMPTCTSKCTSSMEN1 | |
| SCHEMBL7449608 | 0.87 | NR1H4 (0.56) | HDAC1NAMPTMEN1KMT2AL3MBTL1 | |
| SCHEMBL7452537 | 0.85 | HDAC1 (0.49) | HDAC1NAMPTCTSKPPARGPPARA | |
| SCHEMBL5213562 | 0.84 | ATM (0.60) | CTSKCTSSPPARAMEN1KMT2A | |
| SCHEMBL7092624 | 0.83 | ATM (0.64) | CTSKCTSSPPARAMEN1KMT2A | |
| SCHEMBL7455706 | 0.81 | NAMPT (0.48) | HDAC1NAMPTCTSKMEN1KMT2A | |
| SCHEMBL23775465 | 0.80 | ALDH1A1 (0.58) | HDAC1NAMPTMEN1KMT2AHDAC10 | |
| SCHEMBL12133585 | 0.79 | HDAC1 (0.58) | HDAC1NAMPTCTSKPPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001027096-A9 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | PROTHERICS MOLECULAR DESIGN LT (GB) | 2001-07-12 | — | — | WO | disclosed |
| WO-2001027096-A1 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | TULARIK LIMITED (GB) | 2001-04-19 | — | — | WO | disclosed |