Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 5/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | HPGD | P15428 | 5/20 | 0.68 |
| ▸ | CASP1 | P29466 | 5/20 | 0.68 |
| ▸ | CASP7 | P55210 | 5/20 | 0.68 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.68 |
| ▸ | CA12 | O43570 | 4/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.68 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.68 |
| ▸ | GLA | P06280 | 3/20 | 0.68 |
| ▸ | GAA | P10253 | 3/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.68 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.68 |
| ▸ | CA1 | P00915 | 2/20 | 0.68 |
| ▸ | CA7 | P43166 | 2/20 | 0.68 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | AMY1A | P0DUB6 | 2/20 | 0.68 |
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 | |
|---|---|---|---|---|
| Scopoletin SCHEMBL21114360 | 0.81 | CA9 (1.00) | CA9KDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL22273624 | 0.81 | KDM4E (0.71) | CA9KDM4EALDH1A1HPGDCASP1 | |
| Scopoletin SCHEMBL29712325 | 0.81 | CA9 (1.00) | CA9KDM4EALDH1A1HPGDCASP1 | |
| Scopoletin SCHEMBL147702 | 0.81 | CA9 (1.00) | CA9KDM4EALDH1A1HPGDCASP1 | |
| Scopoletin SCHEMBL5060518 | 0.78 | CA9 (0.94) | CA9KDM4EALDH1A1HPGDCASP1 | |
| Esculetin SCHEMBL24641 | 0.77 | CA9 (1.00) | CA9KDM4EALDH1A1HPGDCASP1 | |
| Esculetin SCHEMBL6867015 | 0.77 | CA9 (1.00) | CA9KDM4EALDH1A1HPGDCASP1 | |
| Esculetin SCHEMBL29569228 | 0.77 | CA9 (1.00) | CA9KDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL8807530 | 0.77 | CA9 (0.70) | CA9KDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL31689335 | 0.77 | KDM4E (0.72) | CA9KDM4EALDH1A1HPGDCASP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0900230-B1 | ESCULETIN DERIVATIVES | IDG UK LTD (GB) | 2001-12-12 | — | — | EP | disclosed |
| US-6287798-B1 | COMPOUND WHICH IS HYDROLYZABLE BY MICROORGANISMS FOR DETECTION IN SAMPLES; FORMS BLACK, INSOLUBLE, NONDIFFUSABLE COMPOUND | IDG (UK) LIMITED (GB) | 2001-09-11 | — | — | US | disclosed |
| US-6008008-A | 6- OR 7-SUBSTITUTED DERIVATIVES WHICH ARE MICROBIALLY HYDROLYZABLE TO FLUORESCENT, IRON CHELATING MOIETIES WHICH ARE NONDIFFUSING IN AGAR AND OTHER AQUEOUS ENVIRONMENTS; FOR DETECTION OF MICROORGANISMS | IDG (UK) LIMITED (GB) | 1999-12-28 | — | — | US | disclosed |
| EP-0900230-A2 | ESCULETIN DERIVATIVES | IDG (UK) Limited (GB) | 1999-03-10 | — | — | EP | disclosed |
| WO-1997041138-A2 | ESCULETIN DERIVATIVES | IDG (UK) LIMITED (GB) | 1997-11-06 | — | — | WO | disclosed |