Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | NT5E | P21589 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CASP6 | P55212 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 2/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8967941 | 0.78 | APEX1 (0.54) | APEX1NT5EALDH1A1CASP6HSD17B10 | |
| Aniline SCHEMBL10587235 | 0.75 | AURKA (0.57) | APEX1NT5EALDH1A1CASP6HSD17B10 | |
| SCHEMBL19004039 | 0.74 | CYP1A2 (0.44) | APEX1NT5EALDH1A1CASP6HSD17B10 | |
| SCHEMBL156092 | 0.74 | AURKA (0.62) | NT5EALDH1A1CASP6HSD17B10CYP2C9 | |
| SCHEMBL29706553 | 0.74 | AURKA (0.62) | NT5EALDH1A1CASP6HSD17B10CYP2C9 | |
| SCHEMBL10539390 | 0.74 | AURKA (0.62) | NT5EALDH1A1CASP6HSD17B10CYP2C9 | |
| SCHEMBL445795 | 0.73 | AURKA (0.60) | NT5EALDH1A1CASP6HSD17B10CYP2C9 | |
| SCHEMBL10539372 | 0.73 | AURKA (0.60) | NT5EALDH1A1CASP6HSD17B10CYP2C9 | |
| SCHEMBL6560626 | 0.72 | NT5E (0.51) | APEX1NT5EALDH1A1CASP6HSD17B10 | |
| SCHEMBL9874089 | 0.72 | CASP6 (0.46) | APEX1NT5EALDH1A1CASP6HSD17B10 |
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-5003049-A | Fiber-Reactive Dyes for Hydroxy Textiles | BASF AKTIENGESELLSCHAFT (DE) | 1991-03-26 | — | — | US | disclosed |
| US-4045428-A | Water-soluble reactive naphthylazonaphthyl dyestuffs | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-08-30 | — | — | US | disclosed |