Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | CRHBP | P24387 | 2/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | FABP2 | P12104 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL98746 | 0.85 | ALDH1A1 (0.53) | ALDH1A1TDP1CRHBPCRHR2MEN1 | |
| SCHEMBL29225740 | 0.81 | ALDH1A1 (0.61) | ALDH1A1TDP1MEN1KMT2AMAPT | |
| SCHEMBL18458700 | 0.80 | ERN1 (0.40) | ALDH1A1TDP1MEN1KMT2AMAPT | |
| SCHEMBL11824409 | 0.77 | ADAMTS4 (0.46) | ALDH1A1TDP1MEN1KMT2AMAPT | |
| SCHEMBL18290903 | 0.76 | AKR1C3 (0.61) | ALDH1A1TDP1PTGS2AKR1C3AKR1C2 | |
| SCHEMBL11827104 | 0.76 | ALDH1A1 (0.43) | ALDH1A1TDP1MEN1KMT2AMAPT | |
| SCHEMBL6404321 | 0.76 | ALDH1A1 (0.61) | ALDH1A1TDP1CRHBPCRHR2MEN1 | |
| SCHEMBL2960968 | 0.76 | ALDH1A1 (0.61) | ALDH1A1TDP1CRHBPCRHR2MEN1 | |
| SCHEMBL31349171 | 0.76 | ALDH1A1 (0.61) | ALDH1A1TDP1CRHBPCRHR2MEN1 | |
| SCHEMBL15370340 | 0.75 | ALDH1A1 (0.49) | ALDH1A1TDP1CRHBPCRHR2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118108676-A | Benzenesulfonamide compound, pharmaceutical composition and application thereof | 中国药科大学 | 2024-05-31 | — | — | CN | disclosed |
| EP-2426121-A1 | QUATERNARY AMMONIUM SALT COMPOUND | Teijin Pharma Limited (JP) | 2012-03-07 | — | — | EP | disclosed |