Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 8/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | MAOA | P21397 | 5/20 | 0.46 |
| ▸ | MAOB | P27338 | 5/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | RXRG | P48443 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL31512087 | 1.00 | FFAR4 (0.50) | FFAR4CYP1A2MAOAMAOBRXRA | |
| SCHEMBL7691902 | 0.83 | RXRB (0.56) | FFAR4CYP1A2RXRARXRBRXRG | |
| SCHEMBL7698029 | 0.83 | FFAR4 (0.55) | FFAR4CYP1A2RXRARXRBRXRG | |
| SCHEMBL7542462 | 0.82 | MAOA (0.46) | MAOAMAOBMAPK1 | |
| SCHEMBL1477730 | 0.82 | PBRM1 (0.50) | RXRARXRBRXRG | |
| SCHEMBL1346675 | 0.82 | AKR1B1 (0.52) | MAOAMAOBRXRARXRBRXRG | |
| SCHEMBL7828378 | 0.82 | FFAR4 (0.56) | FFAR4CYP1A2RXRARXRBRXRG | |
| SCHEMBL7535206 | 0.81 | MAOA (0.55) | FFAR4MAOAMAOBRXRARXRB | |
| SCHEMBL1344667 | 0.80 | MAOA (0.49) | MAOAMAOBMAPK1 | |
| SCHEMBL27697415 | 0.79 | RXRB (0.55) | FFAR4CYP1A2RXRARXRBRXRG |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0931086-B1 | TETRAHYDRONAPHTHALENE DERIVATIVES AND THEIR THERAPEUTIC USE | DARWIN DISCOVERY LTD (GB) | 2002-05-02 | — | — | EP | disclosed |
| US-6133240-A | INHIBITION OF SELECTINS, AND THUS OF CELL ADHESION | DARWIN DISCOVERY, LTD. (GB) | 2000-10-17 | — | — | US | disclosed |
| EP-0931086-A1 | TETRAHYDRONAPHTHALENE DERIVATIVES AND THEIR THERAPEUTIC USE | Darwin Discovery Limited (GB) | 1999-07-28 | — | — | EP | disclosed |
| WO-1998009977-A1 | TETRAHYDRONAPTHALENE DERIVATIVES AND THEIR THERAPEUTIC USE | DARWIN DISCOVERY LIMITED (GB) | 1998-03-12 | — | — | WO | disclosed |