Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.78 |
| ▸ | F2 | P00734 | 3/20 | 0.62 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.62 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.62 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.62 |
| ▸ | KDM1A | O60341 | 9/20 | 0.61 |
| ▸ | MAOA | P21397 | 7/20 | 0.61 |
| ▸ | RCOR1 | Q9UKL0 | 3/20 | 0.61 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.61 |
| ▸ | MAOB | P27338 | 2/20 | 0.60 |
| ▸ | CTSL | P07711 | 2/20 | 0.60 |
| ▸ | CTSS | P25774 | 2/20 | 0.60 |
| ▸ | CTSK | P43235 | 2/20 | 0.60 |
| ▸ | CTSB | P07858 | 1/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL4154649 | 0.97 | HDAC8 (0.80) | HDAC8F2PRSS1PRSS2PRSS3 | |
| SCHEMBL10706786 | 0.91 | HDAC8 (0.68) | HDAC8F2CTSLCTSSCTSK | |
| SCHEMBL7370634 | 0.91 | HDAC8 (0.73) | HDAC8F2PRSS1PRSS2PRSS3 | |
| SCHEMBL7970037 | 0.90 | HDAC8 (0.65) | HDAC8F2CTSLCTSSCTSK | |
| SCHEMBL13768102 | 0.89 | LMNA (0.64) | HDAC8F2PRSS1PRSS2PRSS3 | |
| SCHEMBL7130940 | 0.88 | HDAC8 (0.65) | HDAC8F2CTSLCTSSCTSK | |
| SCHEMBL14684392 | 0.87 | HDAC8 (0.64) | HDAC8F2CTSLCTSSCTSK | |
| SCHEMBL17556931 | 0.87 | HDAC8 (0.67) | HDAC8F2PRSS1PRSS2PRSS3 | |
| SCHEMBL22408924 | 0.87 | HDAC8 (0.67) | HDAC8F2PRSS1PRSS2PRSS3 | |
| SCHEMBL7317573 | 0.87 | HDAC8 (0.64) | HDAC8F2CTSLCTSSCTSK |
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-0659737-B1 | Catecholamine surrogates useful as beta 3 agonists | BRISTOL MYERS SQUIBB CO (US) | 2003-03-26 | — | — | EP | disclosed |
| EP-0659737-A2 | Catecholamine surrogates useful as B3 agonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-06-28 | — | — | EP | disclosed |