Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | PPARA | Q07869 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | CTSL | P07711 | 6/20 | 0.52 |
| ▸ | FNTA | P49354 | 1/20 | 0.52 |
| ▸ | FNTB | P49356 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 5/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.51 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.51 |
| ▸ | CTSS | P25774 | 4/20 | 0.50 |
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.48 |
| ▸ | KYNU | Q16719 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4031334 | 1.00 | HDAC4 (0.52) | HDAC4HDAC1HDAC6PPARAALDH1A1 | |
| SCHEMBL4031337 | 1.00 | HDAC4 (0.52) | HDAC4HDAC1HDAC6PPARAALDH1A1 | |
| SCHEMBL8922671 | 0.88 | HDAC1 (0.55) | HDAC4HDAC1HDAC6CTSLFNTA | |
| SCHEMBL8922675 | 0.88 | HDAC1 (0.55) | HDAC4HDAC1HDAC6CTSLFNTA | |
| SCHEMBL1291086 | 0.88 | PPARA (0.57) | PPARAPPARGCTSLFNTAFNTB | |
| SCHEMBL1695001 | 0.88 | PPARA (0.57) | PPARAPPARGCTSLFNTAFNTB | |
| SCHEMBL1157282 | 0.87 | FNTA (0.64) | PPARAALDH1A1ALOX15PPARGCTSL | |
| SCHEMBL6890973 | 0.87 | PPARA (0.60) | PPARAALDH1A1ALOX15PPARGCTSL | |
| SCHEMBL4169134 | 0.87 | FNTA (0.64) | PPARAALDH1A1ALOX15PPARGCTSL | |
| SCHEMBL151601 | 0.87 | FNTA (0.64) | PPARAALDH1A1ALOX15PPARGCTSL |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0629627-B1 | Bicyclic carboxylic acids and their derivatives as nep and aca inhibitors | BRISTOL MYERS SQUIBB CO (US) | 2004-05-06 | — | — | EP | disclosed |
| US-6235922-B1 | COUPLING BY AMIDATION | BRISTOL-MYERS SQUIBB CO. | 2001-05-22 | — | — | US | disclosed |
| EP-0743319-B1 | Benzo-fused azepinone and piperidinone compounds useful in the inhibition of ace and nep | BRISTOL MYERS SQUIBB CO (US) | 2000-09-06 | — | — | EP | disclosed |
| US-5627278-A | MULTISTAGE REACTION FORMED BY AMIDATION, COUPLING AND REDUCTION | BRISTOL-MYERS SQUIBB CO. (US) | 1997-05-06 | — | — | US | disclosed |
| US-5616775-A | ESTERIFYING A N-PROTECTED METHIONINE; OXIDIZING; REACTING WITH AN ACID ANHYDRIDE THEN AN ALKALI METAL HYDROXIDE | BRISTOL-MYERS SQUIBB CO. (US) | 1997-04-01 | — | — | US | disclosed |
| EP-0743319-A1 | Benzo-fused azepinone and piperidinone compounds useful in the inhibition of ace and nep | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-11-20 | — | — | EP | disclosed |
| US-5508272-A | SELECTIVE ACE INHIBITORS, HYPOTENSIVE AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-04-16 | — | — | US | disclosed |
| EP-0629627-A2 | Bicyclic carboxylic acids and their derivatives as nep and aca inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-12-21 | — | — | EP | disclosed |