Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1066003 | 1.00 | ALDH1A1 (0.47) | ALDH1A1HPGDARIDO1KDM4E | |
| SCHEMBL932125 | 0.82 | TDP1 (0.40) | ALDH1A1HPGDARIDO1KDM4E | |
| SCHEMBL17724211 | 0.79 | PDCD1 (0.40) | ALDH1A1HPGDARIDO1KDM4E | |
| SCHEMBL22567484 | 0.79 | GPR35 (0.38) | ALDH1A1HPGDARIDO1KDM4E | |
| SCHEMBL3461978 | 0.79 | TMEM97 (0.47) | ALDH1A1HPGDARKDM4EPOLB | |
| SCHEMBL5315930 | 0.79 | TRPV1 (0.40) | ALDH1A1HPGDARIDO1KDM4E | |
| SCHEMBL1682034 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HPGDARKDM4EPOLB | |
| SCHEMBL7673743 | 0.77 | IDO1 (0.50) | ALDH1A1HPGDARIDO1POLB | |
| SCHEMBL3461975 | 0.77 | ALDH1A1 (0.36) | ALDH1A1HPGDARIDO1KDM4E | |
| SCHEMBL27603742 | 0.77 | SLC16A3 (0.39) | ALDH1A1HPGDARKDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-115298198-A | Novel compounds and compositions for targeted therapy of kidney-related cancers | 上海盟科药业股份有限公司 | 2022-11-04 | — | — | CN | disclosed |