Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1552804 | 0.90 | TSHR (0.38) | MAPTGAAPKMHTTMCL1 | |
| SCHEMBL30125051 | 0.90 | TSHR (0.38) | MAPTGAAPKMHTTMCL1 | |
| SCHEMBL1778574 | 0.80 | TSHR (0.48) | MAPTGAAHTTCYP3A4LMNA | |
| SCHEMBL6681612 | 0.79 | LMNA (0.41) | MAPTLMNACYP2D6CHRM2CHRM1 | |
| SCHEMBL29520654 | 0.78 | CYP3A4 (0.46) | MAPTCYP3A4LMNANPSR1NPC1 | |
| SCHEMBL328909 | 0.78 | CYP3A4 (0.46) | MAPTCYP3A4LMNANPSR1NPC1 | |
| SCHEMBL10640207 | 0.77 | ALDH1A1 (0.33) | HTTCYP3A4CYP2C19TSHR | |
| SCHEMBL628860 | 0.77 | ESR1 (0.59) | ESR1GAACYP3A4CYP2D6SLC22A2 | |
| SCHEMBL29173184 | 0.76 | GABRA1 (0.41) | CYP3A4LMNASLC6A2HTR2CHTR2B | |
| Lithium Ion SCHEMBL19732706 | 0.76 | CYP3A4 (0.44) | MAPTCYP3A4LMNANPSR1NPC1 |
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-5116703-A | Functional hybrid compounds and thin films by sol-gel process | XEROX CORPORATION (US) | 1992-05-26 | — | — | US | disclosed |