Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CDK1 | P06493 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA3 | P07451 | 1/20 | 0.53 |
| ▸ | CA4 | P22748 | 1/20 | 0.53 |
| ▸ | CA6 | P23280 | 1/20 | 0.53 |
| ▸ | CA5A | P35218 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL21177405 | 0.95 | HPGD (0.66) | HPGDCYP1A2CDK1ALDH1A1CA12 | |
| SCHEMBL2566261 | 0.83 | HPGD (0.69) | HPGDCYP1A2ALDH1A1KDM4ETHRB | |
| SCHEMBL7223858 | 0.80 | HPGD (0.68) | HPGDCYP1A2ALDH1A1KDM4ETHRB | |
| SCHEMBL2562980 | 0.79 | CYP1A2 (0.70) | HPGDCYP1A2ALDH1A1KDM4ETHRB | |
| SCHEMBL20694515 | 0.78 | HPGD (0.62) | HPGDCYP1A2ALDH1A1CA1CA2 | |
| SCHEMBL5111555 | 0.77 | P2RX7 (0.66) | HPGDCYP1A2KMT2AMEN1P2RX7 | |
| SCHEMBL21977975 | 0.77 | HPGD (0.78) | HPGDCYP1A2ALDH1A1CA12CA1 | |
| SCHEMBL9778626 | 0.77 | ALDH1A1 (0.68) | HPGDCYP1A2ALDH1A1KDM4EKMT2A | |
| SCHEMBL2564944 | 0.77 | HPGD (0.61) | HPGDCYP1A2ALDH1A1KDM4EHTT | |
| SCHEMBL21177406 | 0.77 | CDK1 (0.49) | HPGDCYP1A2CDK1ALDH1A1CA12 |
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 |