Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 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 | |
|---|---|---|---|---|
| SCHEMBL11687255 | 0.85 | EPHX2 (0.46) | ALDH1A1HTTPOLBGAAMAPT | |
| SCHEMBL2095975 | 0.84 | ALDH1A1 (0.60) | ALDH1A1HTTPOLBGAAMAPT | |
| SCHEMBL11683088 | 0.83 | TP53 (0.57) | POLBLMNAHDAC6NPC1RAB9A | |
| SCHEMBL2095525 | 0.82 | PDK1 (0.49) | ALDH1A1HTTPOLBGAAMAPT | |
| SCHEMBL11004880 | 0.81 | MAPT (0.53) | ALDH1A1HTTGAAMAPTLMNA | |
| SCHEMBL11686582 | 0.80 | MEN1 (0.44) | ALDH1A1POLBHPGDLMNANPC1 | |
| SCHEMBL2094834 | 0.78 | LMNA (0.50) | ALDH1A1HTTPOLBMAPTHPGD | |
| SCHEMBL8350768 | 0.78 | APP (0.44) | ALDH1A1HTTPOLBGAAMAPT | |
| SCHEMBL527095 | 0.78 | MEN1 (0.63) | HTTGAAMAPTLMNAHDAC4 | |
| SCHEMBL26135778 | 0.76 | GRM4 (0.61) | ALDH1A1HTTPOLBMAPTHPGD |
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-2598481-A1 | SULFONAMIDE COMPOUNDS USEFUL AS CYP17 INHIBITORS | Bristol-Myers Squibb Company (US) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012015723-A1 | SULFONAMIDE COMPOUNDS USEFUL AS CYP17 INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-02-02 | — | — | WO | disclosed |