Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | CA9 | Q16790 | 2/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 1/20 | 0.57 |
| ▸ | CA7 | P43166 | 1/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.57 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.48 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11701351 | 0.94 | ALDH1A1 (0.53) | RAB9ANPC1GAAMAPTTSHR | |
| SCHEMBL5167985 | 0.90 | CA12 (0.63) | CA1CA2CA9CA12ESR1 | |
| SCHEMBL11765818 | 0.89 | MAPT (0.54) | CA1CA2CA9CA12CA7 | |
| SCHEMBL11699263 | 0.88 | CA1 (0.71) | CA1CA2CA9CA12ESR1 | |
| SCHEMBL11702741 | 0.88 | ALDH1A1 (0.59) | ESR1SMN1; SMN2RAB9ANPC1GAA | |
| Ethylparaben SCHEMBL5971569 | 0.87 | CA12 (0.77) | CA1CA2CA9CA12ESR1 | |
| SCHEMBL11702063 | 0.86 | CA12 (0.56) | CA1CA2CA9CA12CA7 | |
| SCHEMBL11701606 | 0.83 | CA1 (0.65) | CA1CA2CA9CA12ESR1 | |
| SCHEMBL110051 | 0.83 | ALDH1A1 (0.64) | CA1CA2CA9CA12ESR1 | |
| Benzoic Acid 2-Methylpropyl Ester SCHEMBL31190186 | 0.82 | ALDH1A1 (0.61) | CA1CA2CA9CA12ESR1 |
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-4043976-A | N,N'-DIBENZOYLHYDRAZINE DERIVATIVE | UBE INDUSTRIES, LTD. (JA) | 1977-08-23 | — | — | US | disclosed |