Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.58 |
| ▸ | EGFR | P00533 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | ADH1B | P00325 | 1/20 | 0.45 |
| ▸ | ADH1C | P00326 | 1/20 | 0.45 |
| ▸ | ADH1A | P07327 | 1/20 | 0.45 |
| ▸ | ADH4 | P08319 | 1/20 | 0.45 |
| ▸ | ADH7 | P40394 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Benzaldehyde SCHEMBL9746116 | 1.00 | SIGMAR1 (0.58) | SIGMAR1EGFRALDH1A1CYP2A6TDP1 | |
| Benzaldehyde SCHEMBL2832223 | 1.00 | SIGMAR1 (0.58) | SIGMAR1EGFRALDH1A1CYP2A6TDP1 | |
| Benzaldehyde SCHEMBL1169911 | 0.92 | ALDH1A1 (0.56) | SIGMAR1EGFRALDH1A1CYP2A6TDP1 | |
| Pentadecane SCHEMBL27722034 | 0.88 | ALDH1A1 (0.61) | SIGMAR1EGFRALDH1A1CYP2A6TDP1 | |
| Benzaldehyde SCHEMBL28129001 | 0.88 | ALDH1A1 (0.67) | SIGMAR1EGFRALDH1A1CYP2A6TDP1 | |
| SCHEMBL24512627 | 0.86 | MAOA (0.59) | SIGMAR1LMNACHRM2 | |
| (Z)-1,2-Diphenylethene SCHEMBL5489824 | 0.85 | SIGMAR1 (0.61) | SIGMAR1EGFRALDH1A1TDP1NAAA | |
| Benzaldehyde SCHEMBL4091798 | 0.84 | ALDH1A1 (0.61) | SIGMAR1EGFRALDH1A1CYP2A6TDP1 | |
| Styrene SCHEMBL10628706 | 0.84 | SIGMAR1 (0.56) | SIGMAR1EGFRALDH1A1TDP1NAAA | |
| Styrene SCHEMBL2829376 | 0.84 | SIGMAR1 (0.56) | SIGMAR1EGFRALDH1A1TDP1NAAA |
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-5034277-A | Multilayer element having optical properties and containing hydrazone dyes | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-07-23 | — | — | US | disclosed |
| US-4970120-A | HYDAZONE AND NITRO-SUBSTITUTED PHENYL COMPOUND, AND UNSATURATED AMIDE | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-11-13 | — | — | US | disclosed |