Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | TAS2R38 | P59533 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28960082 | 0.85 | ALDH1A1 (0.41) | PHGDHCYP1A2CYP2C19TAS2R38HSD17B10 | |
| SCHEMBL6695492 | 0.78 | NAPRT (0.42) | HSD17B10ALDH1A1TP53TSHRNAPRT | |
| SCHEMBL10591421 | 0.74 | PHGDH (0.47) | PHGDHCYP1A2CYP2C19TAS2R38HSD17B10 | |
| SCHEMBL7711518 | 0.70 | KMT2A (0.33) | HSD17B10ALDH1A1TSHRSMN1; SMN2GAA | |
| SCHEMBL2001630 | 0.70 | TAS2R38 (0.46) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL14868313 | 0.68 | TAS2R38 (0.45) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL28899654 | 0.68 | ALDH1A1 (0.38) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL28899663 | 0.68 | ALDH1A1 (0.38) | TAS2R38HSD17B10ALDH1A1TP53TSHR | |
| SCHEMBL9505592 | 0.68 | TAS2R38 (0.48) | PHGDHCYP1A2CYP2C19TAS2R38HSD17B10 | |
| SCHEMBL11413702 | 0.67 | SMN1; SMN2 (0.64) | HSD17B10ALDH1A1TP53TSHRNAPRT |
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 |
|---|---|---|---|---|---|---|---|
| CN-115414480-A | Dianhydrogalactitol in combination with radiation for treatment of non-small cell lung cancer and glioblastoma multiforme | 德玛医药 | 2022-12-02 | — | — | CN | disclosed |