Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | G6PD | P11413 | 1/20 | 0.69 |
| ▸ | CASP7 | P55210 | 1/20 | 0.69 |
| ▸ | CASP6 | P55212 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | CA7 | P43166 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.55 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.55 |
| ▸ | CA4 | P22748 | 1/20 | 0.55 |
| ▸ | CA6 | P23280 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.55 |
| ▸ | HNF4A | P41235 | 1/20 | 0.50 |
| ▸ | MYC | P01106 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL29386467 | 1.00 | G6PD (0.69) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL28775060 | 0.96 | G6PD (0.65) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL17744802 | 0.88 | G6PD (0.61) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL9851131 | 0.88 | G6PD (0.65) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL6316176 | 0.83 | G6PD (0.55) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL21114369 | 0.82 | CASP7 (1.00) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL29876454 | 0.82 | ALDH1A1 (0.67) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL1919550 | 0.82 | ALDH1A1 (0.67) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL88229 | 0.82 | CASP7 (1.00) | G6PDCASP7CASP6ALDH1A1KDM4E | |
| SCHEMBL30477210 | 0.82 | CASP7 (1.00) | G6PDCASP7CASP6ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013096151-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2013-06-27 | — | — | WO | disclosed |