Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA3 | P07451 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21177406 | 0.91 | CDK1 (0.49) | HPGDCYP1A2CA12CA1CA2 | |
| SCHEMBL2800276 | 0.78 | SMN1; SMN2 (0.50) | HPGDCYP1A2CA12CA1CA2 | |
| SCHEMBL28472945 | 0.77 | ALDH1A1 (0.48) | HPGDCYP1A2CA12CA1CA2 | |
| SCHEMBL11972812 | 0.73 | AKR1C3 (0.47) | ALDH1A1KDM4EMAPTPTGS2HSD17B10 | |
| SCHEMBL21177628 | 0.71 | LMNA (0.40) | HPGDCYP1A2POLBALDH1A1KDM4E | |
| SCHEMBL8980880 | 0.70 | KDM4E (0.69) | HPGDCYP1A2CA12CA1CA2 | |
| SCHEMBL9665990 | 0.70 | ESRRG (0.60) | HPGDPOLBHTTALDH1A1KDM4E | |
| SCHEMBL24270107 | 0.70 | CYP1A2 (0.62) | HPGDCYP1A2HTTALDH1A1KDM4E | |
| SCHEMBL6650108 | 0.70 | L3MBTL1 (0.48) | HPGDCYP1A2CA12CA1CA2 | |
| SCHEMBL29548598 | 0.70 | CYP1A2 (0.62) | HPGDCYP1A2HTTALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3740489-A1 | PI4KIIIBETA INHIBITORS | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2020-11-25 | — | — | EP | disclosed |
| WO-2019141694-A1 | PI4KIIIBETA INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-07-25 | — | — | WO | disclosed |