Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9235115 | 0.81 | SIRT1 (0.47) | HPGDMAPTALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL10622715 | 0.78 | PDE7A (0.57) | HPGDMAPTALDH1A1PDE7AHTT | |
| SCHEMBL10622769 | 0.76 | HSD17B10 (0.38) | MAPTSIRT1HTTPTGS2PTGS1 | |
| SCHEMBL31457294 | 0.74 | PDE7A (0.56) | HPGDMAPTALDH1A1KDM4ECYP2C9 | |
| SCHEMBL29083004 | 0.71 | HPGD (0.62) | HPGDMAPTALDH1A1KDM4ECYP2C9 | |
| SCHEMBL10917119 | 0.71 | PTGS2 (0.44) | HPGDMAPTCYP2C9CYP2C19PTGS2 | |
| SCHEMBL1000870 | 0.71 | MAPT (0.41) | HPGDMAPTALDH1A1KDM4ECYP2C9 | |
| SCHEMBL5548843 | 0.71 | MAPT (0.57) | HPGDMAPTALDH1A1KDM4ECYP2C9 | |
| SCHEMBL7891113 | 0.70 | HPGD (0.53) | HPGDMAPTALDH1A1KDM4ECYP2C9 | |
| SCHEMBL9631752 | 0.70 | ALDH1A1 (0.61) | HPGDMAPTALDH1A1KDM4ECYP2C9 |
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-4771062-A | ENZYME INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 1988-09-13 | — | — | US | disclosed |