Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.48 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2490664 | 0.88 | SIGMAR1 (0.57) | NPC1RAB9AMEN1KMT2ASIGMAR1 | |
| SCHEMBL6362002 | 0.73 | NPC1 (0.82) | NPC1RAB9AMEN1KMT2ASIGMAR1 | |
| SCHEMBL3696484 | 0.71 | CHKA (0.42) | NPC1RAB9AMEN1KMT2ASIGMAR1 | |
| SCHEMBL136476 | 0.69 | ALDH1A1 (0.67) | NPC1RAB9AMEN1KMT2ADDB1 | |
| SCHEMBL13116710 | 0.69 | SIGMAR1 (0.48) | NPC1RAB9AMEN1KMT2ASIGMAR1 | |
| SCHEMBL8579495 | 0.69 | CA1 (0.44) | RAB9AMEN1KMT2ASIGMAR1DRD3 | |
| SCHEMBL7549211 | 0.69 | SIGMAR1 (0.53) | NPC1RAB9AMEN1KMT2ASIGMAR1 | |
| SCHEMBL76559 | 0.68 | ALDH1A1 (0.59) | NPC1RAB9AMEN1KMT2ADDB1 | |
| SCHEMBL27409503 | 0.68 | ALDH1A1 (0.59) | NPC1RAB9AMEN1KMT2ADDB1 | |
| Hydrochloric Acid SCHEMBL7466356 | 0.68 | ALDH1A1 (0.65) | NPC1RAB9AMEN1KMT2AGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6365602-B1 | FOR THERAPY OF DEPRESSION, ANXIETY, ASTHMA, PAIN, INFLAMMATION, URINARY INCONTINENCE AND OTHER DISEASE CONDITIONS | ASTRA ZENECA AB (SE) | 2002-04-02 | — | — | US | disclosed |