Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL492479 | 1.00 | CYP1A2 (0.47) | CYP1A2TSHRALDH1A1NPC1MEN1 | |
| SCHEMBL27905469 | 0.81 | HTT (0.40) | CYP1A2TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL3330505 | 0.80 | ALDH1A1 (0.45) | CYP1A2TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL3330500 | 0.80 | ALDH1A1 (0.45) | CYP1A2TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL475201 | 0.79 | CYP1A2 (0.72) | CYP1A2TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL475205 | 0.79 | CYP1A2 (0.72) | CYP1A2TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL6808913 | 0.77 | ALDH1A1 (0.38) | CYP1A2ALDH1A1MEN1KMT2AHTT | |
| SCHEMBL5894013 | 0.76 | ALDH1A1 (0.50) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL493277 | 0.76 | KDM4E (0.46) | ALDH1A1MEN1KMT2AHTTGAA | |
| SCHEMBL31248053 | 0.75 | CYP1A2 (0.50) | CYP1A2TSHRALDH1A1HTTGAA |
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-8106066-B2 | Indazoles, benzothiazoles, benzoisothiazoles, benzisoxazoles, pyrazolopyridines, isothiazolopyridines, and preparation and uses thereof | MEMORY PHARMACEUTICALS CORPORATION (US) | 2012-01-31 | — | — | US | disclosed |