Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.50 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.48 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.48 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 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 | |
|---|---|---|---|---|
| SCHEMBL8781669 | 0.88 | NPC1 (0.53) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL8785064 | 0.83 | NPC1 (0.55) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL8880502 | 0.82 | NPC1 (0.65) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL14290745 | 0.81 | ERCC1 (0.40) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL8879604 | 0.81 | NPC1 (0.60) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL1937671 | 0.80 | NPC1 (0.84) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL10439114 | 0.76 | POLB (0.49) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL8781836 | 0.76 | THRB (0.48) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| SCHEMBL8881016 | 0.75 | NPC1 (0.67) | NPC1RAB9AKMT2AMEN1EPHX2 | |
| Dopamantine SCHEMBL122326 | 0.74 | SPHK2 (0.67) | KMT2AMEN1HTTKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008018683-A1 | HYDROXYCINNAMIC ACID DERIVATIVES AND PREPARATION METHOD THEREOF AND COSMETIC COMPOSITION CONTAINING IT | AMOREPACIFIC CORPORATION (KR) | 2008-02-14 | — | — | WO | disclosed |
| EP-0333522-B1 | Catechol derivatives and pharmaceutical preparations containing same | MITSUI TOATSU CHEMICALS (JP) | 1994-08-17 | — | — | EP | disclosed |
| US-5232923-A | Stimulates production of nerve growth factor; administering for treatment of regressive disorders of the central nervous system | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1993-08-03 | — | — | US | disclosed |
| EP-0333522-A2 | Catechol derivatives and pharmaceutical preparations containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1989-09-20 | — | — | EP | disclosed |