Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | PHGDH | O43175 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL8969917 | 0.82 | HPGD (0.38) | ALDH1A1HPGDKDM4EHSD17B10CYP2C9 | |
| SCHEMBL8702 | 0.82 | — | — | |
| Pyridine SCHEMBL28277055 | 0.78 | SIGMAR1 (0.44) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| Pyridine SCHEMBL27502406 | 0.74 | ALDH1A1 (0.45) | ALDH1A1HPGDKDM4EHSD17B10PHGDH | |
| SCHEMBL12427217 | 0.74 | MEN1 (0.56) | ALDH1A1HPGDPHGDHTSHRSMN1; SMN2 | |
| SCHEMBL10590448 | 0.74 | MEN1 (0.56) | ALDH1A1HPGDPHGDHSMN1; SMN2CA12 | |
| Dioxane SCHEMBL25410851 | 0.71 | NAPRT (0.43) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| Pyridine SCHEMBL2946007 | 0.70 | TSHR (0.41) | ALDH1A1HPGDKDM4EHSD17B10CYP2C19 | |
| Pyridine SCHEMBL6730524 | 0.70 | NAPRT (0.60) | ALDH1A1HPGDKDM4ECYP2C9CYP2C19 | |
| Pyridine SCHEMBL936385 | 0.70 | NAPRT (0.60) | ALDH1A1HPGDKDM4ECYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4293642-A | CROSSLINKING WITH CARBODIIMIDE | GAF CORPORATION (US) | 1981-10-06 | — | — | US | disclosed |