Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL9174873 | 0.76 | AKR1B1 (0.47) | ALDH1A1HIF1ATSHRLMNATDP1 | |
| SCHEMBL7565673 | 0.76 | TSHR (0.47) | ALDH1A1HIF1ATSHRLMNATDP1 | |
| SCHEMBL11941648 | 0.74 | AKR1B1 (0.40) | ALDH1A1HIF1ATSHRLMNATDP1 | |
| SCHEMBL17474770 | 0.73 | PTPRC (0.52) | ALDH1A1HIF1ATSHRLMNATDP1 | |
| SCHEMBL11938082 | 0.73 | AKR1B1 (0.42) | ALDH1A1HIF1ATSHRTDP1HSD17B10 | |
| SCHEMBL11938090 | 0.71 | AKR1B1 (0.43) | ALDH1A1HIF1ATSHRTDP1CYP3A4 | |
| SCHEMBL10686639 | 0.70 | ALDH1A1 (0.40) | ALDH1A1HIF1ATSHRLMNATDP1 | |
| SCHEMBL10577722 | 0.70 | AKR1B1 (0.48) | ALDH1A1HIF1ATSHRLMNATDP1 | |
| SCHEMBL22833802 | 0.69 | PNMT (0.43) | ADRA2APNMTKDM1ATDP2 | |
| SCHEMBL29506360 | 0.69 | PNMT (0.43) | ADRA2APNMTKDM1ATDP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102414195-A | Fused heterocyclic compound and use thereof | SUMITOMO CHEMICAL CO | 2012-04-11 | — | — | CN | disclosed |
| EP-0635483-B1 | Process for preparing nitroaniline derivatives | SUMITOMO CHEMICAL CO (JP) | 1997-10-22 | — | — | EP | disclosed |
| US-5466871-A | Amination of a nitrobenzene with a hydroxylamine | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-11-14 | — | — | US | disclosed |
| EP-0635483-A1 | Process for preparing nitroaniline derivatives | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-01-25 | — | — | EP | disclosed |