Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.41 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP9 | P55211 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27997553 | 0.82 | GAA (0.44) | ALDH1A1CYP1A2GAANPSR1KDM4E | |
| SCHEMBL7774207 | 0.79 | HPGD (0.37) | ALDH1A1GAAHSD17B10SMN1; SMN2TSHR | |
| SCHEMBL1444265 | 0.77 | ALDH1A1 (0.48) | ALDH1A1GAANPSR1KDM4EHSD17B10 | |
| SCHEMBL16559854 | 0.74 | ALDH1A1 (0.55) | ALDH1A1CYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL1387968 | 0.74 | GAA (0.42) | ALDH1A1CYP1A2CYP2C19GAANPSR1 | |
| SCHEMBL7028752 | 0.73 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2C19GAANPSR1 | |
| SCHEMBL7033340 | 0.73 | PPARA (0.59) | ALDH1A1CYP2C19GAANPSR1KDM4E | |
| SCHEMBL4517104 | 0.73 | MEN1 (0.57) | ALDH1A1NPSR1KDM4EPOLBPABPC1 | |
| SCHEMBL20564353 | 0.73 | HPGD (0.41) | ALDH1A1GAAKDM4EPOLBSMN1; SMN2 | |
| SCHEMBL12611682 | 0.72 | GAA (0.55) | ALDH1A1CYP1A2CYP2C19GAANPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102958914-B | 1-phenyl substituted heterocyclic derivatives and their use as prostaglandin D2 receptor modulators | ACTELION PHARMACEUTICALS LTD | 2015-05-27 | — | — | CN | disclosed |
| CN-104428305-A | 1-phenyl-substituted heterocyclyl derivatives and their use as prostaglandin d2 receptor modulators | ACTELION PHARMACEUTICALS LTD | 2015-03-18 | — | — | CN | disclosed |