Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.56 |
| ▸ | TACR1 | P25103 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | MIF | P14174 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31530566 | 0.89 | NPC1 (0.73) | NPC1RAB9ASMN1; SMN2EPHX2TACR1 | |
| SCHEMBL10615093 | 0.87 | SMN1; SMN2 (0.81) | NPC1RAB9ASMN1; SMN2EPHX2GAA | |
| SCHEMBL7379230 | 0.78 | CNR1 (0.72) | SMN1; SMN2CACNA1BCNR1CNR2KMT2A | |
| SCHEMBL6443540 | 0.77 | CTSK (0.60) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5947652 | 0.77 | EPHX2 (0.81) | NPC1RAB9ASMN1; SMN2EPHX2CNR1 | |
| SCHEMBL5304990 | 0.77 | MMP2 (0.53) | TACR1CNR1CNR2KMT2AMEN1 | |
| Hippuric Acid SCHEMBL8957458 | 0.77 | HIF1A (0.59) | NPC1RAB9ASMN1; SMN2GAAMIF | |
| SCHEMBL7561649 | 0.76 | NPC1 (0.70) | NPC1RAB9ASMN1; SMN2EPHX2GAA | |
| SCHEMBL13495002 | 0.75 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2EPHX2GAA | |
| SCHEMBL2062871 | 0.75 | HDAC1 (0.73) | RAB9AEPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6124280-A | FOR TREATMENT OF NERVOUS SYSTEM DISORDERS | WARNER-LAMBERT COMPANY (US) | 2000-09-26 | — | — | US | disclosed |
| WO-1997005125-A1 | SUBSTITUTED PHENOLS AS NOVEL CALCIUM CHANNEL BLOCKERS | WARNER-LAMBERT COMPANY (US) | 1997-02-13 | — | — | WO | disclosed |