Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.59 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | PHGDH | O43175 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14528664 | 0.82 | HPGD (0.65) | HPGDHSD11B1ALDH1A1KDM4EMAPT | |
| SCHEMBL10720943 | 0.80 | PHGDH (0.81) | HPGDALDH1A1KDM4EMAPTHTT | |
| SCHEMBL4618652 | 0.80 | ALDH1A1 (0.84) | HPGDALDH1A1KDM4EMAPTHTT | |
| SCHEMBL1359639 | 0.79 | HPGD (0.63) | HPGDHSD11B1ALDH1A1KDM4EMAPT | |
| SCHEMBL22387605 | 0.78 | HSD11B1 (0.62) | HPGDHSD11B1ALDH1A1KDM4EMAPT | |
| SCHEMBL2742813 | 0.77 | NPC1 (0.66) | HPGDALDH1A1KDM4EMAPTHTT | |
| SCHEMBL3824666 | 0.77 | GSK3B (0.66) | HPGDALDH1A1KDM4EMAPTHTT | |
| SCHEMBL7403944 | 0.75 | HPGD (0.55) | HPGDALDH1A1MAPTHTTPHGDH | |
| SCHEMBL60648 | 0.75 | KMO (0.67) | HPGDALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28296651 | 0.75 | HPGD (0.86) | HPGDALDH1A1KDM4EMAPTHTT |
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-112370452-A | Heterocyclic amides as kinase inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2021-02-19 | — | — | CN | disclosed |
| CN-107624111-B | Heterocyclic amides as kinase inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2020-11-03 | — | — | CN | disclosed |